N-(phenylmethyl)-1-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyl]piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyl]piperidine-4-carboxamide Openeye Name: N-benzyl-1-[3-[4-(1-piperidylsulfonyl)phenyl]propanoyl]piperidine-4-carboxamide CAS Name: 1-[1-oxo-3-[4-(1-piperidinylsulfonyl)phenyl]propyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[3-(4-piperidin-1-ylsulfonylphenyl)propanoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[3-(4-piperidinosulfonylphenyl)propanoyl]isonipecotamide Formula: C27H35N3O4S MolecularWeight: 497.6495

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35N3O4S/c31-26(29-19-15-24(16-20-29)27(32)28-21-23-7-3-1-4-8-23)14-11-22-9-12-25(13-10-22)35(33,34)30-17-5-2-6-18-30/h1,3-4,7-10,12-13,24H,2,5-6,11,14-21H2,(H,28,32)