(3S)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-N-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-N-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide Openeye Name: (3S)-5-oxo-N-(4-phenylthiazol-2-yl)-1-(p-tolylmethyl)pyrrolidine-3-carboxamide CAS Name: (3S)-1-[(4-methylphenyl)methyl]-5-oxo-N-(4-phenyl-2-thiazolyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-[(4-methylphenyl)methyl]-5-oxo-N-(4-phenyl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-(4-methylbenzyl)-N-(4-phenylthiazol-2-yl)pyrrolidine-3-carboxamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)CN2C[C@H](CC2=O)C(=O)NC3=NC(=CS3)C4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-15-7-9-16(10-8-15)12-25-13-18(11-20(25)26)21(27)24-22-23-19(14-28-22)17-5-3-2-4-6-17/h2-10,14,18H,11-13H2,1H3,(H,23,24,27)/t18-/m0/s1