[2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: [2-[ethanoyl-(3-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-ethanoyl-1-methyl-pyrrole-2-carboxylate Openeye Name: [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl 4-acetyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-acetyl-1-methyl-2-pyrrolecarboxylic acid [2-(N-acetyl-3-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-3-methylanilino)-1,3-thiazol-4-yl]methyl 4-acetyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-acetyl-1-methyl-pyrrole-2-carboxylic acid [2-(N-acetyl-3-methyl-anilino)thiazol-4-yl]methyl ester Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=CC(=CN3C)C(=O)C)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(C2=NC(=CS2)COC(=O)C3=CC(=CN3C)C(=O)C)C(=O)C

InChI

InChI=1S/C21H21N3O4S/c1-13-6-5-7-18(8-13)24(15(3)26)21-22-17(12-29-21)11-28-20(27)19-9-16(14(2)25)10-23(19)4/h5-10,12H,11H2,1-4H3