N-(2,3-dimethylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide

Systemtic Name: N-(2,3-dimethylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(2,3-dimethylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-4-oxo-butanamide CAS Name: N-(2,3-dimethylcyclohexyl)-4-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(2,3-dimethylcyclohexyl)-4-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: N-(2,3-dimethylcyclohexyl)-4-keto-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]butyramide Formula: C23H34N4O6S MolecularWeight: 494.60426

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CCCC(C1C)NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C23H34N4O6S/c1-16-5-4-6-20(18(16)3)24-22(28)9-10-23(29)25-11-13-26(14-12-25)34(32,33)21-15-19(27(30)31)8-7-17(21)2/h7-8,15-16,18,20H,4-6,9-14H2,1-3H3,(H,24,28)