N-(4-methylphenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-benzenesulfonamide hydrochloride

Systemtic Name: N-(4-methylphenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]carbonyl-benzenesulfonamide hydrochloride Openeye Name: 4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-N-(p-tolyl)benzenesulfonamide hydrochloride CAS Name: N-(4-methylphenyl)-4-[oxo-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]methyl]benzenesulfonamide hydrochloride IUPAC Name: N-(4-methylphenyl)-4-[4-[(E)-3-phenylprop-2-enyl]piperazine-1-carbonyl]benzenesulfonamide hydrochloride Traditional Name: 4-[4-[(E)-cinnamyl]piperazine-1-carbonyl]-N-(p-tolyl)benzenesulfonamide hydrochloride Formula: C27H30ClN3O3S MolecularWeight: 512.0634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)CC=CC4=CC=CC=C4.Cl

Isomeric SMILES

CC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C/C=C/C4=CC=CC=C4.Cl

InChI

InChI=1S/C27H29N3O3S.ClH/c1-22-9-13-25(14-10-22)28-34(32,33)26-15-11-24(12-16-26)27(31)30-20-18-29(19-21-30)17-5-8-23-6-3-2-4-7-23;/h2-16,28H,17-21H2,1H3;1H/b8-5+;