N-[2-methyl-5-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-phenyl]ethanamide

Systemtic Name: N-[2-methyl-5-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazin-1-yl]carbonyl-phenyl]ethanamide Openeye Name: N-[2-methyl-5-[4-(4-methylsulfonyl-2-nitro-phenyl)piperazine-1-carbonyl]phenyl]acetamide CAS Name: N-[2-methyl-5-[[4-(4-methylsulfonyl-2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]acetamide IUPAC Name: N-[2-methyl-5-[4-(4-methylsulfonyl-2-nitrophenyl)piperazine-1-carbonyl]phenyl]acetamide Traditional Name: N-[5-[4-(4-mesyl-2-nitro-phenyl)piperazine-1-carbonyl]-2-methyl-phenyl]acetamide Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-])NC(=O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)S(=O)(=O)C)[N+](=O)[O-])NC(=O)C

InChI

InChI=1S/C21H24N4O6S/c1-14-4-5-16(12-18(14)22-15(2)26)21(27)24-10-8-23(9-11-24)19-7-6-17(32(3,30)31)13-20(19)25(28)29/h4-7,12-13H,8-11H2,1-3H3,(H,22,26)