[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl 4-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl 4-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 4-(2-oxo-1-pyrrolidinyl)benzoic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl 4-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 4-(2-ketopyrrolidino)benzoic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H21N3O3S/c1-15-4-8-17(9-5-15)23-22-24-18(14-29-22)13-28-21(27)16-6-10-19(11-7-16)25-12-2-3-20(25)26/h4-11,14H,2-3,12-13H2,1H3,(H,23,24)