1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Openeye Name: N-[[2-(1-piperidylmethyl)phenyl]methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: 1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(1-piperidinylmethyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: 1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]piperidine-4-carboxamide Traditional Name: N-[2-(piperidinomethyl)benzyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C27H35N3O3S MolecularWeight: 481.6501

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC2=CC=CC=C2CNC(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O3S/c31-27(28-21-25-11-5-6-12-26(25)22-29-16-7-2-8-17-29)24-13-18-30(19-14-24)34(32,33)20-15-23-9-3-1-4-10-23/h1,3-6,9-12,15,20,24H,2,7-8,13-14,16-19,21-22H2,(H,28,31)/b20-15+