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

Systemtic Name: (3S)-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-oxidanylidene-N-(phenylmethyl)pyrrolidine-3-carboxamide Openeye Name: (3S)-N-benzyl-1-[4-[(4-methyl-1-piperidyl)sulfonyl]phenyl]-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-5-oxo-N-(phenylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-benzyl-1-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-benzyl-5-keto-1-[4-(4-methylpiperidino)sulfonylphenyl]pyrrolidine-3-carboxamide Formula: C24H29N3O4S MolecularWeight: 455.56976

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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=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O4S/c1-18-11-13-26(14-12-18)32(30,31)22-9-7-21(8-10-22)27-17-20(15-23(27)28)24(29)25-16-19-5-3-2-4-6-19/h2-10,18,20H,11-17H2,1H3,(H,25,29)/t20-/m0/s1