2-(2,5-dimethylphenyl)-6-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(2,5-dimethylphenyl)-6-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(2,5-dimethylphenyl)-6-[4-(4-fluorophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(2,5-dimethylphenyl)-6-[[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(2,5-dimethylphenyl)-6-[4-(4-fluorophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(2,5-dimethylphenyl)-6-[4-(4-fluorophenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Formula: C23H25FN4O4S MolecularWeight: 472.532403

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H25FN4O4S/c1-16-3-4-17(2)21(15-16)28-22(29)10-9-20(25-28)23(30)26-11-13-27(14-12-26)33(31,32)19-7-5-18(24)6-8-19/h3-8,15H,9-14H2,1-2H3