N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitro-aniline CAS Name: N-[2-methyl-3-(4-methyl-1-piperazinyl)propyl]-4-[(4-methyl-1-piperazinyl)sulfonyl]-2-nitroaniline IUPAC Name: N-[2-methyl-3-(4-methylpiperazin-1-yl)propyl]-4-(4-methylpiperazin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [2-methyl-3-(4-methylpiperazino)propyl]-[4-(4-methylpiperazino)sulfonyl-2-nitro-phenyl]amine Formula: C20H34N6O4S MolecularWeight: 454.58676

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)[N+](=O)[O-])CN3CCN(CC3)C

Isomeric SMILES

CC(CNC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C)[N+](=O)[O-])CN3CCN(CC3)C

InChI

InChI=1S/C20H34N6O4S/c1-17(16-24-10-6-22(2)7-11-24)15-21-19-5-4-18(14-20(19)26(27)28)31(29,30)25-12-8-23(3)9-13-25/h4-5,14,17,21H,6-13,15-16H2,1-3H3