Compound Search
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基于 PubChem CID 索引，支持名称 / 同义词 / CAS / SMILES 检索。
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Benzeneacetic acid, 4-(methylsulfonyl)-; Acetic acid, [p-(methylsulfonyl)phenyl]- (7CI); (4-Methanesulfonylphenyl)acetic acid; 2-[4-(Methylsulfonyl)phenyl]acetic acid; 4-(Methylsulfonyl)benzeneacetic acid; 4-(Methylsulfonyl)phenylacetic acid; 4-Mesylphenylacetic acid; Etoricoxib Related Compound B CAS 90536-66-6 PubChem CID 572345
CS(=O)(=O)c1ccc(CC(=O)O)cc1 -
1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetic acid, compound with piperazine (2:1) CAS 18833-13-1 PubChem CID 6453414
C1CNCCN1.Cn1c(=O)c2c(ncn2CC(=O)O)n(C)c1=O -
Rosiglitazone Related Compound A (25 mg) ((5Z)-5-{[4-({2-[methyl(2-pyridinyl)amino]ethyl}oxy)phenyl]methylidene}-1,3-thiazolidine-2,4-dione) CAS 122320-74-5 PubChem CID 10111070
CN(CCOc1ccc(/C=C2/SC(=O)NC2=O)cc1)c1ccccn1 -
[3aR-(3aalpha,4alpha,6alpha,6aalpha)]-6-Aminotetrahydro-2,2-dimethyl-4H-cyclopenta-1,3-dioxol-4-ol; (3aS,4R,6S,6aR)-6-Hydroxy-2,2-dimethyltetrahydro-3aH-cyclopenta[d][1,3]dioxol-4-amine CAS 155899-66-4 PubChem CID 10352168
CC1(C)O[C@@H]2[C@H](O1)[C@@H](O)C[C@H]2N -
1,3,5-TRIAZINE-2,4,6(1H,3H,5H)-TRIONE COMPOUND WITH 6-(2-(2-METHYL-1H-IMIDAZOL-1-YL)ETHYL)-1,3,5-TRIAZINE-2,4-DIAMINE (1:1) CAS 68490-66-4 PubChem CID 11110832
Cc1nccn1CCc1nc(N)nc(N)n1.O=c1[nH]c(=O)[nH]c(=O)[nH]1 -
Amlodipine USP Related Compound F; Amlodipine Dimethyl Ester; 3-Methyl 5-methyl 4-(2-chlorophenyl)-6-methyl-2-[[2- [(2-aminoethoxy)methyl]-1,4-dihydropyridine-3,5-dicarboxylate; 2-[(2-Aminoethoxy)methyl]-4-(2-chlorophenyl)-1,4-dihydro-6-methyl-3,5-pyridinedicarboxylic Acid 3,5-dimethyl Ester CAS 140171-66-0 PubChem CID 11200267
COC(=O)C1=C(C)NC(COCCN)=C(C(=O)OC)C1c1ccccc1Cl -
3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-6,7-dimethoxy-, hydrochloride (1:1), (3S)- CAS 30740-95-5 PubChem CID 12248066
COc1cc2c(cc1OC)CC(C(=O)O)NC2.Cl -
3-(Diphenylmethoxy)-1,2-propanediol; 3-(Benzhydryloxy)propane-1,2-diol; Diphenhydramine Related Compound B CAS 19574-66-4 PubChem CID 19895186
OCC(O)COC(c1ccccc1)c1ccccc1 -
1-(4-(tert-Butyl)benzyl)-4-((4-chlorophenyl)(phenyl)methyl)piperazine (S)-5-oxopyrrolidine-2-carboxylate CAS 93963-66-7 PubChem CID 57356339
CC(C)(C)c1ccc(CN2CCN(C(c3ccccc3)c3ccc(Cl)cc3)CC2)cc1.O=C1CC[C@@H](C(=O)O)N1 -
(+)1-(4-bromophenyl)-3-[4- ethyl-2,5-dioxo-4-(propan-2- yl)imidazolidin-1-yl]urea PubChem CID 71572153
CCC1(C(C)C)NC(=O)N(NC(=O)Nc2ccc(Br)cc2)C1=O -
5-tert-butyl-N-[[2-fluoro-4-[6-(1-methylpyrazol-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-4-yl]phenyl]methyl]-1,2,4-oxadiazole-3-carboxamide CAS 2230724-66-8 PubChem CID 90125978
Cn1cc(-c2cc3c(-c4ccc(CNC(=O)c5noc(C(C)(C)C)n5)c(F)c4)ncnc3[nH]2)cn1 -
Tetrahydrogen bis(8-hydroxyquinoline-5,7-disulphonato(3-)-O7,O8)cuprate(4-), compound with diethylamine (1:4) CAS 84100-66-3 PubChem CID 91844637
CCNCC.CCNCC.CCNCC.CCNCC.O=S(=O)(O)c1cc(S(=O)(=O)O)c2cccnc2c1O.O=S(=O)(O)c1cc(S(=O)(=O)O)c2cccnc2c1O.[Cu].[H+].[H+].[H+].[H+] -
3-((6-Chloro-7-fluoro-1-(2-(3-(4-fluorobenzyl)pyrrolidin-1-yl)-2-oxoethyl)-2-methyl-1H-indol-3-yl)thio)benzoic acid PubChem CID 117979035
Cc1c(Sc2cccc(C(=O)O)c2)c2ccc(Cl)c(F)c2n1CC(=O)N1CCC(Cc2ccc(F)cc2)C1 -
(5P)-6-amino-2-[(3S,4S)-4-amino- 3-methyl-2-oxa-8- azaspiro[4.5]decan-8-yl]-5-(2,3- dichlorophenyl)-pyrimidine-4- carboxamide PubChem CID 155089349
C[C@@H]1OCC2(CCN(c3nc(N)c(-c4cccc(Cl)c4Cl)c(C(N)=O)n3)CC2)[C@@H]1N -
cis-8-4-((4-fluorophenyl)(((R)-tetrahydrofuran-3-yl) methyl)amino)cyclohexyl)(methyl)amino)-5-methyl- 6-oxo-5,6-dihydro-1,5-naphthyridine-2,7- dicarbonitrile PubChem CID 164539533
CN(c1c(C#N)c(=O)n(C)c2ccc(C#N)nc12)C1CCC(N(CC2CCOC2)c2ccc(F)cc2)CC1 -
US20230382904, Compound 33 PubChem CID 169552333
C[C@H](NC(=O)c1cc(-c2cc(C(=O)NC3CCNC3)c3nc(N)nn3c2)cs1)c1ccc(F)cc1 -
US20240140931, Compound 16 PubChem CID 171454834
C#Cc1ccc2c(c1)[C@@H](N)C1(CCN(c3cc(=O)n(-c4cccc(Cl)c4F)c(C)n3)CC1)C2 -
5-Acetamido-1,3,4-thiadiazole-2-sulfonamide;N-(5-[Aminosulfonyl]-1,3,4-thiadiazol-2-yl)acetamide;N-(5-Sulfamoyl-1,3,4-thiadiazol-2-yl)acetamide CAS 59-66-5 PubChem CID 1986
CC(=O)Nc1nnc(S(N)(=O)=O)s1 -
3-Quinolineethanol, 6-bromo-a-[2-(dimethylamino)ethyl]-2-methoxy-a-1-naphthalenyl-ss-phenyl-, (aS,ssR)-; (aS,ssR)-6-Bromo-a-[2-(dimethylamino)ethyl]-2-methoxy-a-1-naphthalenyl-ss-phenyl-3-quinolineethanol; Bedaquiline; R 207910; Sirturo; TMC 207; (aS,ssR)-Bedaquiline CAS 843663-66-1 PubChem CID 5388906
COc1nc2ccc(Br)cc2cc1[C@@H](c1ccccc1)[C@@](O)(CCN(C)C)c1cccc2ccccc12 -
Carbamic acid, N-[4-[3-[[[7-(hydroxyamino)-7-oxoheptyl]amino]carbonyl]-5-isoxazolyl]phenyl]-, 1,1-dimethylethyl ester CAS 1045792-66-2 PubChem CID 24951314
CC(C)(C)OC(=O)Nc1ccc(-c2cc(C(=O)NCCCCCCC(=O)NO)no2)cc1