N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide

Systemtic Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Openeye Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide CAS Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinecarboxamide IUPAC Name: N-(2,3-dimethyl-5-sulfamoylphenyl)-1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carboxamide Traditional Name: N-(2,3-dimethyl-5-sulfamoyl-phenyl)-1-[(E)-3-phenylacryloyl]isonipecotamide Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C23H27N3O4S/c1-16-14-20(31(24,29)30)15-21(17(16)2)25-23(28)19-10-12-26(13-11-19)22(27)9-8-18-6-4-3-5-7-18/h3-9,14-15,19H,10-13H2,1-2H3,(H,25,28)(H2,24,29,30)/b9-8+