N-(phenylmethyl)-1-[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(phenylmethyl)-1-[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-benzyl-1-[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]piperidine-4-carboxamide CAS Name: 1-[(E)-1-oxo-3-[4-(propylsulfamoyl)phenyl]prop-2-enyl]-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-[(E)-3-[4-(propylsulfamoyl)phenyl]prop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-benzyl-1-[(E)-3-[4-(propylsulfamoyl)phenyl]acryloyl]isonipecotamide Formula: C25H31N3O4S MolecularWeight: 469.59634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=CC=C(C=C1)C=CC(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCNS(=O)(=O)C1=CC=C(C=C1)/C=C/C(=O)N2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C25H31N3O4S/c1-2-16-27-33(31,32)23-11-8-20(9-12-23)10-13-24(29)28-17-14-22(15-18-28)25(30)26-19-21-6-4-3-5-7-21/h3-13,22,27H,2,14-19H2,1H3,(H,26,30)/b13-10+