[2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl (3S)-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-methylphenyl)amino]-1,3-thiazol-4-yl]methyl (3S)-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-methylanilino)thiazol-4-yl]methyl (3S)-1-cyclopentyl-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3S)-1-cyclopentyl-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-methylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(4-methylanilino)-1,3-thiazol-4-yl]methyl (3S)-1-cyclopentyl-5-oxopyrrolidine-3-carboxylate Traditional Name: (3S)-1-cyclopentyl-5-keto-pyrrolidine-3-carboxylic acid [2-(p-toluidino)thiazol-4-yl]methyl ester Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)C3CC(=O)N(C3)C4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=CS2)COC(=O)[C@H]3CC(=O)N(C3)C4CCCC4

InChI

InChI=1S/C21H25N3O3S/c1-14-6-8-16(9-7-14)22-21-23-17(13-28-21)12-27-20(26)15-10-19(25)24(11-15)18-4-2-3-5-18/h6-9,13,15,18H,2-5,10-12H2,1H3,(H,22,23)/t15-/m0/s1