(3S)-N-(2-methyl-1,3-benzothiazol-6-yl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(2-methyl-1,3-benzothiazol-6-yl)-1-[(4-methylphenyl)methyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(2-methyl-1,3-benzothiazol-6-yl)-5-oxo-1-(p-tolylmethyl)pyrrolidine-3-carboxamide CAS Name: (3S)-N-(2-methyl-1,3-benzothiazol-6-yl)-1-[(4-methylphenyl)methyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(2-methyl-1,3-benzothiazol-6-yl)-1-[(4-methylphenyl)methyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-(2-methyl-1,3-benzothiazol-6-yl)-1-(4-methylbenzyl)pyrrolidine-3-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CC(CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

Isomeric SMILES

CC1=CC=C(C=C1)CN2C[C@H](CC2=O)C(=O)NC3=CC4=C(C=C3)N=C(S4)C

InChI

InChI=1S/C21H21N3O2S/c1-13-3-5-15(6-4-13)11-24-12-16(9-20(24)25)21(26)23-17-7-8-18-19(10-17)27-14(2)22-18/h3-8,10,16H,9,11-12H2,1-2H3,(H,23,26)/t16-/m0/s1