Compound Search
化合物数据库
基于 PubChem CID 索引,支持名称 / 同义词 / CAS / SMILES 检索。
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2,3-Dihydro-4-methyl-2-[2-(2-methyl-1-pyrrolidinyl)ethyl]pyrido[3,2-f][1,4]oxazepine-5(4H)-thione fumarate PubChem CID 14391511
CC(C)O.CC1CCCN1CCC1CN(C)C(=S)c2cccnc2O1.O=C(O)/C=C/C(=O)O -
2-methyl-6-((1R,2R,4S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)cyclohexanol compound with 2-methyl-6 CAS 1212466-56-2 PubChem CID 16403003
CC1CCCC(C2CC3CC2C(C)C3(C)C)C1O.CC1CCCC(C2CC3CCC2(C)C3(C)C)C1O -
Anastrozole USP Related Compound E; 2,2'-[5-(Dibromomethyl)-1,3-phenylene]-bis(methylpropionitrile); CAS 1027160-12-8 PubChem CID 16666890
CC(C)(C#N)c1cc(C(Br)Br)cc(C(C)(C)C#N)c1 -
methyl 2-(4-isopropyl-4-methyl-5-oxo-4,5-dihydro-1H-imidazol-2-yl)-4-methylbenzoate compound with methyl CAS 81405-85-8 PubChem CID 21873022
COC(=O)c1cc(C)ccc1C1=NC(C)(C(C)C)C(=O)N1.COC(=O)c1ccc(C)cc1C1=NC(C)(C(C)C)C(=O)N1 -
Entry compound 33: N- (2-Fluorophenyl)-2-((3- (furan-2-ylmethyl)-4-oxo- 3,4-dihydropteridin-2- yl CAS 902850-08-2 PubChem CID 22518416
Cc1ccccc1NC(=O)CSc1nc2nccnc2c(=O)n1Cc1ccco1 -
Benazepril USP Related Compound G; Benazepril Ethyl Ester; Benazepril ethyl diester analog; Ethyl (2S CAS 103129-58-4 PubChem CID 22824504
CCOC(=O)CN1C(=O)[C@@H](N[C@H](CCc2ccccc2)C(=O)OCC)CCc2ccccc21 -
14-(2-hydroxypentan-2-yl)-7-methoxy-3-methyl-1,2,3,4,7,7a-hexahydro-4a,7-ethano-4,12-methanobenzofuro CAS 39456-59-2 PubChem CID 23681189
O=P(O)(O)O.[F-].[Na+] -
2-Oxazolidinone, 4-[[3-[2-(dimethyloxidoamino)ethyl]-1H-indol-5-yl]methyl]-, (4S)-; (4S)-4-[[3-[2-(Dimethyloxidoamino CAS 251451-30-6 PubChem CID 25241756
C[N+](C)([O-])CCc1c[nH]c2ccc(C[C@H]3COC(=O)N3)cc12 -
N-[4-Cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorophenyl)sulfinyl]-2-hydroxy-2-methylpropanamide; Propanamide CAS 945419-64-7 PubChem CID 42604713
CC(O)(CS(=O)c1ccc(F)cc1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1 -
2-(4-((1-(((2-Methoxy-5-sulphophenyl)amino)carbonyl)-2-oxopropyl)azo)phenyl)-6-methylbenzothiazole-7- CAS 85392-18-3 PubChem CID 44145268
CC(O)CN(CC(C)O)CC(C)O.COc1ccc(S(=O)(=O)[O-])cc1NC(=O)C(N=Nc1ccc(-c2nc3ccc(C)c(S(=O)(=O)[O-])c3s2)cc1)C(C)=O.[Na+].[Na+] -
4,4'-bis[[6-anilino-4-[bis(2-hydroxyethyl)amino]-1,3,5 triazin-2-yl]amino]stilbene-2,2'-disulfonic acid CAS 93965-04-9 PubChem CID 44145556
O=S(=O)([O-])c1cc(Nc2nc(Nc3ccccc3)nc(N(CCO)CCO)n2)ccc1/C=C/c1ccc(Nc2nc(Nc3ccccc3)nc(N(CCO)CCO)n2)cc1S(=O)(=O)[O-].OCCNCCO.[NH4+].[NH4+] -
(2-Hydroxyethyl)ammonium phosphate, compound with N-(2-aminoethyl)-N'-(2-((2-aminoethyl)amino)ethyl)ethylenediamine CAS 84145-05-1 PubChem CID 44145713
NCCNCCNCCNCCN.O=P([O-])([O-])[O-].[NH3+]CCO.[NH3+]CCO.[NH3+]CCO -
4,4'-bis[[4-[(2-cyanoethyl)(2-hydroxyethyl)amino]-6-[(4-sulphophenyl)amino]-1,3,5-triazin-2-yl]amino] CAS 94030-81-6 PubChem CID 44145893
N#CCCN(CCO)c1nc(Nc2ccc(S(=O)(=O)O)cc2)nc(Nc2ccc(/C=C/c3ccc(Nc4nc(Nc5ccc(S(=O)(=O)O)cc5)nc(N(CCO)CCC#N)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)n1.NCCO.NCCO.NCCO.NCCO -
2-Naphthalenesulfonic acid, 4-hydroxy-7-[[[[5-hydroxy-6-[(2-methoxyphenyl)azo]-7-sulfo-2-naphthalenyl CAS 83763-86-4 PubChem CID 44145942
CN(CCO)CCO.COc1ccccc1N/N=C1/C(=O)c2ccc(NC(=O)Nc3ccc4c(c3)C=C(S(=O)(=O)[O-])/C(=N/Nc3ccc5cc(S(=O)(=O)[O-])ccc5c3)C4=O)cc2C=C1S(=O)(=O)[O-].[Na+].[Na+].[Na+] -
(6R-trans)-3-(Acetoxymethyl)-7-(2-cyanoacetamido)-8-oxo-5-thia-1-azabicyclo(4.2.0)oct-2-ene-2-carboxylic CAS 84803-50-9 PubChem CID 44146850
CC(=O)OCC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)CC#N)[C@H]2SC1.NCCO -
Formic acid, compound with (Z)-N-[2-[[2-(2-hydroxyethoxy)ethyl](2-hydroxyethyl)amino]ethyl]-9-octadecenamide CAS 82808-57-9 PubChem CID 44147037
CCCCCCCC/C=C\CCCCCCCC(=O)NCCN(CCO)CCOCCO.O=CO -
4,4'-bis[[4-amino-6-[bis(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl]amino]stilbene-2,2'-disulphonic acid CAS 93893-35-7 PubChem CID 44147357
NCCO.NCCO.Nc1nc(Nc2ccc(/C=C/c3ccc(Nc4nc(N)nc(N(CCO)CCO)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)nc(N(CCO)CCO)n1 -
4,4'-bis[[6-anilino-4-[(3-amino-3-oxopropyl)(2-hydroxyethyl)amino]-1,3,5-triazin-2-yl]amino]stilbene- CAS 94030-82-7 PubChem CID 44147554
NC(=O)CCN(CCO)c1nc(Nc2ccccc2)nc(Nc2ccc(/C=C/c3ccc(Nc4nc(Nc5ccccc5)nc(N(CCO)CCC(N)=O)n4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)n1.NCCO.NCCO -
Dodecanedioic acid, compound with N-(2-aminoethyl)-N'-(2-((2-aminoethyl)amino)ethyl)ethane-1,2-diamine CAS 94135-65-6 PubChem CID 44147626
NCCNCCNCCNCCN.O=C(O)CCCCCCCCCCC(=O)O.OCCN(CCO)CCO -
1H-Naphtho[1,2-d]triazolium, 2-[4-[[1-[[(2-methoxyphenyl)amino]carbonyl]-2-oxopropyl]azo]-3-sulfophenyl CAS 83763-76-2 PubChem CID 44149249
COc1ccccc1NC(=O)C([NH+]=Nc1ccc(-n2nc3c(S(=O)(=O)[O-])cc4cc(S(=O)(=O)[O-])ccc4c3n2)cc1S(=O)(=O)[O-])C(C)=O.OCCN(CCO)CCO.[Na+].[Na+]