1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: 1-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-benzyl-1-[4-(2-ketopyrrolidino)phenyl]sulfonyl-isonipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

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