N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-[methyl(phenyl)sulfamoyl]phenyl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C25H27N5O5S MolecularWeight: 509.57738

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N(C)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H27N5O5S/c1-27-13-15-29(16-14-27)23-12-11-19(17-24(23)30(32)33)25(31)26-20-7-6-10-22(18-20)36(34,35)28(2)21-8-4-3-5-9-21/h3-12,17-18H,13-16H2,1-2H3,(H,26,31)