N-(phenylmethyl)-1-(3-piperidin-1-ylsulfonylphenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-(3-piperidin-1-ylsulfonylphenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-benzyl-1-[3-(1-piperidylsulfonyl)benzoyl]piperidine-4-carboxamide CAS Name: 1-[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(3-piperidin-1-ylsulfonylbenzoyl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(3-piperidinosulfonylbenzoyl)isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4S/c29-24(26-19-20-8-3-1-4-9-20)21-12-16-27(17-13-21)25(30)22-10-7-11-23(18-22)33(31,32)28-14-5-2-6-15-28/h1,3-4,7-11,18,21H,2,5-6,12-17,19H2,(H,26,29)