[2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-chloranyl-1H-indole-2-carboxylate

Systemtic Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-chloranyl-1H-indole-2-carboxylate Openeye Name: [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl 3-chloro-1H-indole-2-carboxylate CAS Name: 3-chloro-1H-indole-2-carboxylic acid [2-(3,4-dimethoxyphenyl)-4-thiazolyl]methyl ester IUPAC Name: [2-(3,4-dimethoxyphenyl)-1,3-thiazol-4-yl]methyl 3-chloro-1H-indole-2-carboxylate Traditional Name: 3-chloro-1H-indole-2-carboxylic acid [2-(3,4-dimethoxyphenyl)thiazol-4-yl]methyl ester Formula: C21H17ClN2O4S MolecularWeight: 428.88868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C4=CC=CC=C4N3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=CS2)COC(=O)C3=C(C4=CC=CC=C4N3)Cl)OC

InChI

InChI=1S/C21H17ClN2O4S/c1-26-16-8-7-12(9-17(16)27-2)20-23-13(11-29-20)10-28-21(25)19-18(22)14-5-3-4-6-15(14)24-19/h3-9,11,24H,10H2,1-2H3