N-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]benzamide

Systemtic Name: N-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]benzamide Openeye Name: N-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]benzamide CAS Name: N-methyl-3-[(4-methyl-1-piperazinyl)sulfonyl]-N-[[4-(methylthio)phenyl]methyl]benzamide IUPAC Name: N-methyl-3-(4-methylpiperazin-1-yl)sulfonyl-N-[(4-methylsulfanylphenyl)methyl]benzamide Traditional Name: N-methyl-3-(4-methylpiperazino)sulfonyl-N-[4-(methylthio)benzyl]benzamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(C)CC3=CC=C(C=C3)SC

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)C(=O)N(C)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H27N3O3S2/c1-22-11-13-24(14-12-22)29(26,27)20-6-4-5-18(15-20)21(25)23(2)16-17-7-9-19(28-3)10-8-17/h4-10,15H,11-14,16H2,1-3H3