3-cyano-N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]benzamide

Systemtic Name: 3-cyano-N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]benzamide Openeye Name: 3-cyano-N-[3-[4-(m-tolyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 3-cyano-N-[3-[[4-(3-methylphenyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 3-cyano-N-[3-[4-(3-methylphenyl)piperazin-1-yl]sulfonylpropyl]benzamide Traditional Name: 3-cyano-N-[3-[4-(m-tolyl)piperazino]sulfonylpropyl]benzamide Formula: C22H26N4O3S MolecularWeight: 426.53184

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H26N4O3S/c1-18-5-2-8-21(15-18)25-10-12-26(13-11-25)30(28,29)14-4-9-24-22(27)20-7-3-6-19(16-20)17-23/h2-3,5-8,15-16H,4,9-14H2,1H3,(H,24,27)