6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-2,4-dihydro-1H-pyridazin-3-one

Systemtic Name: 6-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]carbonyl-2,4-dihydro-1H-pyridazin-3-one Openeye Name: 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2,4-dihydro-1H-pyridazin-3-one CAS Name: 6-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2,4-dihydro-1H-pyridazin-3-one IUPAC Name: 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2,4-dihydro-1H-pyridazin-3-one Traditional Name: 6-[4-(2,5-dimethylphenyl)sulfonylpiperazine-1-carbonyl]-2,4-dihydro-1H-pyridazin-3-one Formula: C17H22N4O4S MolecularWeight: 378.44598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CCC(=O)NN3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CCC(=O)NN3

InChI

InChI=1S/C17H22N4O4S/c1-12-3-4-13(2)15(11-12)26(24,25)21-9-7-20(8-10-21)17(23)14-5-6-16(22)19-18-14/h3-5,11,18H,6-10H2,1-2H3,(H,19,22)