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

Systemtic Name: 3-[5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]carbonyl-pyrazol-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]pyrazol-1-yl]-1H-pyridazin-6-one CAS Name: 3-[5-methyl-4-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-1-pyrazolyl]-1H-pyridazin-6-one IUPAC Name: 3-[5-methyl-4-[4-(4-nitrophenyl)sulfonylpiperazine-1-carbonyl]pyrazol-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[5-methyl-4-(4-nosylpiperazine-1-carbonyl)pyrazol-1-yl]-1H-pyridazin-6-one Formula: C19H19N7O6S MolecularWeight: 473.46246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N7O6S/c1-13-16(12-20-25(13)17-6-7-18(27)22-21-17)19(28)23-8-10-24(11-9-23)33(31,32)15-4-2-14(3-5-15)26(29)30/h2-7,12H,8-11H2,1H3,(H,22,27)