3-(tert-butylsulfamoyl)-N-[(1-methylpiperidin-3-yl)methyl]-5-[[(E)-3-phenylprop-2-enyl]amino]benzamide

Systemtic Name: 3-(tert-butylsulfamoyl)-N-[(1-methylpiperidin-3-yl)methyl]-5-[[(E)-3-phenylprop-2-enyl]amino]benzamide Openeye Name: 3-(tert-butylsulfamoyl)-5-[[(E)-cinnamyl]amino]-N-[(1-methyl-3-piperidyl)methyl]benzamide CAS Name: 3-(tert-butylsulfamoyl)-N-[(1-methyl-3-piperidinyl)methyl]-5-[[(E)-3-phenylprop-2-enyl]amino]benzamide IUPAC Name: 3-(tert-butylsulfamoyl)-N-[(1-methylpiperidin-3-yl)methyl]-5-[[(E)-3-phenylprop-2-enyl]amino]benzamide Traditional Name: 3-(tert-butylsulfamoyl)-5-[[(E)-cinnamyl]amino]-N-[(1-methyl-3-piperidyl)methyl]benzamide Formula: C27H38N4O3S MolecularWeight: 498.68062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1)NCC=CC2=CC=CC=C2)C(=O)NCC3CCCN(C3)C

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC(=CC(=C1)NC/C=C/C2=CC=CC=C2)C(=O)NCC3CCCN(C3)C

InChI

InChI=1S/C27H38N4O3S/c1-27(2,3)30-35(33,34)25-17-23(26(32)29-19-22-13-9-15-31(4)20-22)16-24(18-25)28-14-8-12-21-10-6-5-7-11-21/h5-8,10-12,16-18,22,28,30H,9,13-15,19-20H2,1-4H3,(H,29,32)/b12-8+