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

Systemtic Name: N-(2-methylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-4-oxidanylidene-butanamide Openeye Name: N-(2-methylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazin-1-yl]-4-oxo-butanamide CAS Name: N-(2-methylcyclohexyl)-4-[4-(2-methyl-5-nitrophenyl)sulfonyl-1-piperazinyl]-4-oxobutanamide IUPAC Name: N-(2-methylcyclohexyl)-4-[4-(2-methyl-5-nitrophenyl)sulfonylpiperazin-1-yl]-4-oxobutanamide Traditional Name: 4-keto-N-(2-methylcyclohexyl)-4-[4-(2-methyl-5-nitro-phenyl)sulfonylpiperazino]butyramide Formula: C22H32N4O6S MolecularWeight: 480.57768

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CCCCC1NC(=O)CCC(=O)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C

InChI

InChI=1S/C22H32N4O6S/c1-16-5-3-4-6-19(16)23-21(27)9-10-22(28)24-11-13-25(14-12-24)33(31,32)20-15-18(26(29)30)8-7-17(20)2/h7-8,15-16,19H,3-6,9-14H2,1-2H3,(H,23,27)