4-[[(3-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]methyl]-N-(2-pyridin-2-ylsulfanylethyl)benzamide

Systemtic Name: 4-[[(3-chlorophenyl)-(4-methylphenyl)sulfonyl-amino]methyl]-N-(2-pyridin-2-ylsulfanylethyl)benzamide Openeye Name: 4-[[3-chloro-N-(p-tolylsulfonyl)anilino]methyl]-N-[2-(2-pyridylsulfanyl)ethyl]benzamide CAS Name: 4-[(3-chloro-N-(4-methylphenyl)sulfonylanilino)methyl]-N-[2-(2-pyridinylthio)ethyl]benzamide IUPAC Name: 4-[(3-chloro-N-(4-methylphenyl)sulfonylanilino)methyl]-N-(2-pyridin-2-ylsulfanylethyl)benzamide Traditional Name: 4-[(3-chloro-N-tosyl-anilino)methyl]-N-[2-(2-pyridylthio)ethyl]benzamide Formula: C28H26ClN3O3S2 MolecularWeight: 552.10734

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NCCSC3=CC=CC=N3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(CC2=CC=C(C=C2)C(=O)NCCSC3=CC=CC=N3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C28H26ClN3O3S2/c1-21-8-14-26(15-9-21)37(34,35)32(25-6-4-5-24(29)19-25)20-22-10-12-23(13-11-22)28(33)31-17-18-36-27-7-2-3-16-30-27/h2-16,19H,17-18,20H2,1H3,(H,31,33)