N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methylpiperazin-1-yl)butyl]amino]-3-nitro-benzenesulfonamide

Systemtic Name: N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methylpiperazin-1-yl)butyl]amino]-3-nitro-benzenesulfonamide Openeye Name: N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methylpiperazin-1-yl)butyl]amino]-3-nitro-benzenesulfonamide CAS Name: N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methyl-1-piperazinyl)butyl]amino]-3-nitrobenzenesulfonamide IUPAC Name: N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methylpiperazin-1-yl)butyl]amino]-3-nitrobenzenesulfonamide Traditional Name: N-(4-methylcyclohexyl)-4-[[3-methyl-2-(4-methylpiperazino)butyl]amino]-3-nitro-benzenesulfonamide Formula: C23H39N5O4S MolecularWeight: 481.65186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCC(C(C)C)N3CCN(CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCC(CC1)NS(=O)(=O)C2=CC(=C(C=C2)NCC(C(C)C)N3CCN(CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C23H39N5O4S/c1-17(2)23(27-13-11-26(4)12-14-27)16-24-21-10-9-20(15-22(21)28(29)30)33(31,32)25-19-7-5-18(3)6-8-19/h9-10,15,17-19,23-25H,5-8,11-14,16H2,1-4H3