N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-(2-oxo-1-pyrrolidinyl)phenyl]-1-(3-phenylpropylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(2-oxopyrrolidin-1-yl)phenyl]-1-(3-phenylpropylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-1-(3-phenylpropylsulfonyl)isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3CCN(CC3)S(=O)(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c29-24-9-4-16-28(24)23-12-10-22(11-13-23)26-25(30)21-14-17-27(18-15-21)33(31,32)19-5-8-20-6-2-1-3-7-20/h1-3,6-7,10-13,21H,4-5,8-9,14-19H2,(H,26,30)