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

Systemtic Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-methyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[[2-(1-pyrrolidinyl)phenyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-1-[(E)-2-phenylethenyl]sulfonyl-N-[(2-pyrrolidin-1-ylphenyl)methyl]piperidine-4-carboxamide Traditional Name: N-methyl-N-(2-pyrrolidinobenzyl)-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C26H33N3O3S MolecularWeight: 467.62352

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3CCN(CC3)S(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=CC=C1N2CCCC2)C(=O)C3CCN(CC3)S(=O)(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C26H33N3O3S/c1-27(21-24-11-5-6-12-25(24)28-16-7-8-17-28)26(30)23-13-18-29(19-14-23)33(31,32)20-15-22-9-3-2-4-10-22/h2-6,9-12,15,20,23H,7-8,13-14,16-19,21H2,1H3/b20-15+