N-[[3-(methylcarbamoyl)phenyl]methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-[(E)-2-phenylethenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-[(E)-styryl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-[(E)-2-phenylethenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[3-(methylcarbamoyl)phenyl]methyl]-1-[(E)-2-phenylethenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[3-(methylcarbamoyl)benzyl]-1-[(E)-styryl]sulfonyl-isonipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)CNC(=O)C2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C23H27N3O4S/c1-24-22(27)21-9-5-8-19(16-21)17-25-23(28)20-10-13-26(14-11-20)31(29,30)15-12-18-6-3-2-4-7-18/h2-9,12,15-16,20H,10-11,13-14,17H2,1H3,(H,24,27)(H,25,28)/b15-12+