2-methyl-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-methyl-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-nitro-benzenesulfonamide Openeye Name: 2-methyl-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-nitro-benzenesulfonamide CAS Name: 2-methyl-N-[2-[4-(4-methyl-1-piperazinyl)phenyl]ethyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-methyl-N-[2-[4-(4-methylpiperazin-1-yl)phenyl]ethyl]-5-nitrobenzenesulfonamide Traditional Name: 2-methyl-N-[2-[4-(4-methylpiperazino)phenyl]ethyl]-5-nitro-benzenesulfonamide Formula: C20H26N4O4S MolecularWeight: 418.50984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC=C(C=C2)N3CCN(CC3)C

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCCC2=CC=C(C=C2)N3CCN(CC3)C

InChI

InChI=1S/C20H26N4O4S/c1-16-3-6-19(24(25)26)15-20(16)29(27,28)21-10-9-17-4-7-18(8-5-17)23-13-11-22(2)12-14-23/h3-8,15,21H,9-14H2,1-2H3