2-[(3,4-dimethoxyphenyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(3,4-dimethoxyphenyl)amino]-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-(3,4-dimethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]thiazole-4-carboxamide CAS Name: 2-(3,4-dimethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-(3,4-dimethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-(3,4-dimethoxyanilino)-N-[2-(1H-indol-3-yl)ethyl]thiazole-4-carboxamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)NCCC3=CNC4=CC=CC=C43)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC(=CS2)C(=O)NCCC3=CNC4=CC=CC=C43)OC

InChI

InChI=1S/C22H22N4O3S/c1-28-19-8-7-15(11-20(19)29-2)25-22-26-18(13-30-22)21(27)23-10-9-14-12-24-17-6-4-3-5-16(14)17/h3-8,11-13,24H,9-10H2,1-2H3,(H,23,27)(H,25,26)