4-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-[2-(phenylmethylsulfanyl)ethyl]benzamide

Systemtic Name: 4-[(4-methylphenyl)methyl-methylsulfonyl-amino]-N-[2-(phenylmethylsulfanyl)ethyl]benzamide Openeye Name: N-(2-benzylsulfanylethyl)-4-[methylsulfonyl(p-tolylmethyl)amino]benzamide CAS Name: 4-[(4-methylphenyl)methyl-methylsulfonylamino]-N-[2-(phenylmethylthio)ethyl]benzamide IUPAC Name: N-(2-benzylsulfanylethyl)-4-[(4-methylphenyl)methyl-methylsulfonylamino]benzamide Traditional Name: N-[2-(benzylthio)ethyl]-4-[mesyl-(4-methylbenzyl)amino]benzamide Formula: C25H28N2O3S2 MolecularWeight: 468.63142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CN(C2=CC=C(C=C2)C(=O)NCCSCC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H28N2O3S2/c1-20-8-10-21(11-9-20)18-27(32(2,29)30)24-14-12-23(13-15-24)25(28)26-16-17-31-19-22-6-4-3-5-7-22/h3-15H,16-19H2,1-2H3,(H,26,28)