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。
-
Phosphorothioic acid, O-(3-chloro-4-nitrophenyl) O,O-di-Me ester (6CI); BAY 22190; Chlorothion; Chlorthion CAS 500-28-7 PubChem CID 10372
COP(=S)(OC)Oc1ccc([N+](=O)[O-])c(Cl)c1 -
Benzoic acid, 4-chloro-, methyl ester; Benzoic acid, p-chloro-, methyl ester (6CI,7CI,8CI); 4-(Methoxycarbonyl CAS 1126-46-1 PubChem CID 14307
COC(=O)c1ccc(Cl)cc1 -
1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4-ethyl-4,9-dihydroxy-, (4S)-; 1H-Pyrano CAS 19685-09-7 PubChem CID 97226
CC[C@@]1(O)C(=O)OCc2c1cc1n(c2=O)Cc2cc3cc(O)ccc3nc2-1 -
5-(4-nitrophenyl)-2-furaldehyde azine; 2-Furancarboxaldehyde, 5-(4-nitrophenyl)-, 2-[[5-(4-nitrophenyl CAS 301359-05-7 PubChem CID 3131750
O=[N+]([O-])c1ccc(-c2ccc(C=NN=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)o2)cc1 -
(2ss,3a,5a,16ss,17ss)-2-(4-Morpholinyl)-16-(1-pyrrolidinyl)-androstane-3,17-diol 17-acetate; (2ss,3a, CAS 119302-24-8 PubChem CID 16064933
CC(=O)O[C@H]1[C@@H](N2CCCC2)C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@@H](N5CCOCC5)C[C@]4(C)[C@H]3CC[C@@]21C -
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 -
Levocabastine Related Compound A (50 mg) (1-[cis-4-cyano-4-(4-fluorophenyl)cyclohexyl]-4-phenylpiperidine CAS 80139-91-9 PubChem CID 70517239
Cl.N#CC1(c2ccc(F)cc2)CCC(N2CCC(C(=O)O)(c3ccccc3)CC2)CC1 -
N-[(2S)-1-[(2S,4R)-4-hydroxy-2-({[4-(4-methyl-1,3-thiazol-5-yl)phenyl]methyl}carbamoyl)pyrrolidin-1-yl PubChem CID 168252895
Cc1ncsc1-c1ccc(CNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](NC(=O)CCCCCC(=O)NCCOCCOCCNC(=O)c2ccc3c(c2)c2cn(C)nc2n3-c2ccc(C(F)(F)F)cc2)C(C)(C)C)cc1 -
4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-4-METHYL-TETRAHYDRO-PYRAN;COMPOUND WITH N-HYDROXY-ACETAMIDE PubChem CID 5111
O=C(CC1(S(=O)(=O)c2ccc(Oc3ccc(Cl)cc3)cc2)CCOCC1)NO -
C (EP); Sulfamethazine USP Related Compound A; Sulfamethazine USP RC A; (4-Aminophenylsulfonyl)guanidine CAS 57-67-0 PubChem CID 5324
NC(N)=NS(=O)(=O)c1ccc(N)cc1 -
Benzyldimethyl[2-[2-[p-(1,1,3,3-tetramethylbutyl)phenoxy]ethoxy]ethyl]ammonium chloride; N,N-Dimethyl-N-[2-[2-[4- CAS 121-54-0 PubChem CID 8478
CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1.[Cl-] -
(RS)-Benoxaprofen; 2-[2-(4-Chlorophenyl)benzoxazol-5-yl]-propanoic acid; 299582Q1; Benoxaprofen; Compound CAS 51234-28-7 PubChem CID 39941
CC(C(=O)O)c1ccc2oc(-c3ccc(Cl)cc3)nc2c1 -
E (EP); 3-Oxoandrost-4-en-17beta-yl Hexanoate; Androst-4-en-3-one, 17-[(1-oxohexyl)oxy]-, (17beta)-; CAS 10312-45-5 PubChem CID 112100
CCCCCC(=O)O[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]12C -
(4-Hydroxy-3-methoxy-5-nitrophenyl)(4-methylphenyl)methanone; 4-Hydroxy-3-methoxy-4'-methyl-5-nitrobenzophenone CAS 134612-80-9 PubChem CID 126117
COc1cc(C(=O)c2ccc(C)cc2)cc([N+](=O)[O-])c1O -
1H-Pyrano[3',4':6,7]indolizino[1,2-b]quinoline-3,14(4H,12H)-dione, 4,11-diethyl-4-hydroxy-, (4S)-; 1H-Pyrano CAS 78287-27-1 PubChem CID 127584
CCc1c2c(nc3ccccc13)-c1cc3c(c(=O)n1C2)COC(=O)[C@]3(O)CC -
Diltiazem USP Related Compound G; N-Desmethyl O-Desacetyl Diltiazem; (2S,3S)-5-[2-(Methylamino)ethyl] CAS 86408-44-8 PubChem CID 158945
CNCCN1C(=O)[C@H](O)[C@H](c2ccc(OC)cc2)Sc2ccccc21 -
N~1~,N~1~-Diethyl-N~4~-(5-fluoro-4-quinolinyl)-1,4-pentanediamine compound with N~1~,N~1~-diethyl-N~4 PubChem CID 248589
CCN(CC)CCCC(C)Nc1ccnc2cc(F)ccc12.CCN(CC)CCCC(C)Nc1ccnc2cccc(F)c12 -
5-{[(4-methylphenyl)sulfonyl]oxy}pentyl 4-methylbenzenesulfonate compound with 2-(2-{[(4-methylphenyl PubChem CID 316658
Cc1ccc(S(=O)(=O)OCCCCCOS(=O)(=O)c2ccc(C)cc2)cc1.Cc1ccc(S(=O)(=O)OCCOCCOS(=O)(=O)c2ccc(C)cc2)cc1 -
(R)-2,3,6,7,12,13,16,17-Octahydro-9-[4-[[[4-hydroxy-4-oxido-10-oxo-7-[(1-oxohexadecyl)oxy]-3,5,9-trioxa CAS 187099-99-6 PubChem CID 643970
CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)(O)OCCNS(=O)(=O)c1ccc(C2=c3cc4c5c(c3Oc3c2cc2c6c3CCCN6CCC2)CCC[N+]=5CCC4)c(S(=O)(=O)[O-])c1)OC(=O)CCCCCCCCCCCCCCC.CCN(CC)CC -
dithiobis[2,6-di-tert-butyl- (7CI,8CI); 4,4'-Dithiobis[2,6-di-tert-butylphenol]; Bis(3,5-di-tert-butyl-4- CAS 6386-58-9 PubChem CID 1575463
CC(C)(C)c1cc(SSc2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)cc(C(C)(C)C)c1O