(3S)-5-oxidanylidene-1-(phenylmethyl)-N-(4-piperidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide

Systemtic Name: (3S)-5-oxidanylidene-1-(phenylmethyl)-N-(4-piperidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide Openeye Name: (3S)-1-benzyl-5-oxo-N-[4-(1-piperidylsulfonyl)phenyl]pyrrolidine-3-carboxamide CAS Name: (3S)-5-oxo-1-(phenylmethyl)-N-[4-(1-piperidinylsulfonyl)phenyl]-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-benzyl-5-oxo-N-(4-piperidin-1-ylsulfonylphenyl)pyrrolidine-3-carboxamide Traditional Name: (3S)-1-benzyl-5-keto-N-(4-piperidinosulfonylphenyl)pyrrolidine-3-carboxamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CC(=O)N(C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CC(=O)N(C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S/c27-22-15-19(17-25(22)16-18-7-3-1-4-8-18)23(28)24-20-9-11-21(12-10-20)31(29,30)26-13-5-2-6-14-26/h1,3-4,7-12,19H,2,5-6,13-17H2,(H,24,28)/t19-/m0/s1