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

Systemtic Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-methyl-N-[[2-(1-piperidyl)phenyl]methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(1-piperidinyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[(2-piperidin-1-ylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-methyl-N-(2-piperidinobenzyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C27H35N3O3S MolecularWeight: 481.6501

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCCC2)C(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C27H35N3O3S/c1-28(22-25-12-6-7-13-26(25)29-17-8-3-9-18-29)27(31)24-14-19-30(20-15-24)34(32,33)21-16-23-10-4-2-5-11-23/h2,4-7,10-13,16,21,24H,3,8-9,14-15,17-20,22H2,1H3/b21-16+