4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide

Systemtic Name: 4-[[(3-methylphenyl)-methylsulfonyl-amino]methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide Openeye Name: 4-[(3-methyl-N-methylsulfonyl-anilino)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide CAS Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-[3-(4-methyl-1-piperazinyl)propyl]benzamide IUPAC Name: 4-[(3-methyl-N-methylsulfonylanilino)methyl]-N-[3-(4-methylpiperazin-1-yl)propyl]benzamide Traditional Name: 4-[(N-mesyl-3-methyl-anilino)methyl]-N-[3-(4-methylpiperazino)propyl]benzamide Formula: C24H34N4O3S MolecularWeight: 458.61676

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCCCN3CCN(CC3)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC2=CC=C(C=C2)C(=O)NCCCN3CCN(CC3)C)S(=O)(=O)C

InChI

InChI=1S/C24H34N4O3S/c1-20-6-4-7-23(18-20)28(32(3,30)31)19-21-8-10-22(11-9-21)24(29)25-12-5-13-27-16-14-26(2)15-17-27/h4,6-11,18H,5,12-17,19H2,1-3H3,(H,25,29)