6-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-2-(2-methylphenyl)-1,4-dihydropyridazin-3-one

Systemtic Name: 6-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]carbonyl-2-(2-methylphenyl)-1,4-dihydropyridazin-3-one Openeye Name: 6-[4-(4-bromophenyl)sulfonylpiperazine-1-carbonyl]-2-(o-tolyl)-1,4-dihydropyridazin-3-one CAS Name: 6-[[4-(4-bromophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2-(2-methylphenyl)-1,4-dihydropyridazin-3-one IUPAC Name: 6-[4-(4-bromophenyl)sulfonylpiperazine-1-carbonyl]-2-(2-methylphenyl)-1,4-dihydropyridazin-3-one Traditional Name: 6-(4-brosylpiperazine-1-carbonyl)-2-(o-tolyl)-1,4-dihydropyridazin-3-one Formula: C22H23BrN4O4S MolecularWeight: 519.41142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)CC=C(N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)CC=C(N2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H23BrN4O4S/c1-16-4-2-3-5-20(16)27-21(28)11-10-19(24-27)22(29)25-12-14-26(15-13-25)32(30,31)18-8-6-17(23)7-9-18/h2-10,24H,11-15H2,1H3