[2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1H-indole-3-carboxylate

Systemtic Name: [2-[(2,6-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl 1H-indole-3-carboxylate Openeye Name: [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl 1H-indole-3-carboxylate CAS Name: 1H-indole-3-carboxylic acid [2-(N-acetyl-2,6-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2,6-dimethylanilino)-1,3-thiazol-4-yl]methyl 1H-indole-3-carboxylate Traditional Name: 1H-indole-3-carboxylic acid [2-(N-acetyl-2,6-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C23H21N3O3S MolecularWeight: 419.49614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CNC4=CC=CC=C43)C(=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)N(C2=NC(=CS2)COC(=O)C3=CNC4=CC=CC=C43)C(=O)C

InChI

InChI=1S/C23H21N3O3S/c1-14-7-6-8-15(2)21(14)26(16(3)27)23-25-17(13-30-23)12-29-22(28)19-11-24-20-10-5-4-9-18(19)20/h4-11,13,24H,12H2,1-3H3