(3S)-N-[(4-methylphenyl)methyl]-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-[(4-methylphenyl)methyl]-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-5-oxo-N-(p-tolylmethyl)pyrrolidine-3-carboxamide CAS Name: (3S)-N-[(4-methylphenyl)methyl]-1-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-[(4-methylphenyl)methyl]-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-N-(4-methylbenzyl)-1-[4-(4-methylpiperidino)sulfonylphenyl]pyrrolidine-3-carboxamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3CC(CC3=O)C(=O)NCC4=CC=C(C=C4)C

Isomeric SMILES

CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N3C[C@H](CC3=O)C(=O)NCC4=CC=C(C=C4)C

InChI

InChI=1S/C25H31N3O4S/c1-18-3-5-20(6-4-18)16-26-25(30)21-15-24(29)28(17-21)22-7-9-23(10-8-22)33(31,32)27-13-11-19(2)12-14-27/h3-10,19,21H,11-17H2,1-2H3,(H,26,30)/t21-/m0/s1