4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]benzamide

Systemtic Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[(3-methylphenyl)-phenyl-methyl]benzamide Openeye Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[m-tolyl(phenyl)methyl]benzamide CAS Name: 4-[(4-ethylsulfonyl-1-piperazinyl)methyl]-N-[(3-methylphenyl)-phenylmethyl]benzamide IUPAC Name: 4-[(4-ethylsulfonylpiperazin-1-yl)methyl]-N-[(3-methylphenyl)-phenylmethyl]benzamide Traditional Name: 4-[(4-esylpiperazino)methyl]-N-[m-tolyl(phenyl)methyl]benzamide Formula: C28H33N3O3S MolecularWeight: 491.64492

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC(=C4)C

Isomeric SMILES

CCS(=O)(=O)N1CCN(CC1)CC2=CC=C(C=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC(=C4)C

InChI

InChI=1S/C28H33N3O3S/c1-3-35(33,34)31-18-16-30(17-19-31)21-23-12-14-25(15-13-23)28(32)29-27(24-9-5-4-6-10-24)26-11-7-8-22(2)20-26/h4-15,20,27H,3,16-19,21H2,1-2H3,(H,29,32)