[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-(1H-indol-3-yl)propanoate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 3-(1H-indol-3-yl)propanoate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 3-(1H-indol-3-yl)propanoate CAS Name: 3-(1H-indol-3-yl)propanoic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 3-(1H-indol-3-yl)propanoate Traditional Name: 3-(1H-indol-3-yl)propionic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C22H21N3O2S/c1-15-6-9-17(10-7-15)24-22-25-18(14-28-22)13-27-21(26)11-8-16-12-23-20-5-3-2-4-19(16)20/h2-7,9-10,12,14,23H,8,11,13H2,1H3,(H,24,25)