3,4-dimethyl-5-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyridazin-6-one

Systemtic Name: 3,4-dimethyl-5-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-1H-pyridazin-6-one Openeye Name: 3,4-dimethyl-5-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-1H-pyridazin-6-one CAS Name: 3,4-dimethyl-5-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1H-pyridazin-6-one IUPAC Name: 3,4-dimethyl-5-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]-1H-pyridazin-6-one Traditional Name: 3,4-dimethyl-5-(4-nosylpiperazine-1-carbonyl)-1H-pyridazin-6-one Formula: C17H19N5O6S MolecularWeight: 421.42766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NN=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=O)NN=C1C)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H19N5O6S/c1-11-12(2)18-19-16(23)15(11)17(24)20-7-9-21(10-8-20)29(27,28)14-5-3-13(4-6-14)22(25)26/h3-6H,7-10H2,1-2H3,(H,19,23)