2-(4-bromophenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one

Systemtic Name: 2-(4-bromophenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-(4-bromophenyl)-4,5-dihydropyridazin-3-one CAS Name: 6-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-2-(4-bromophenyl)-4,5-dihydropyridazin-3-one IUPAC Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-(4-bromophenyl)-4,5-dihydropyridazin-3-one Traditional Name: 6-(4-besylpiperazine-1-carbonyl)-2-(4-bromophenyl)-4,5-dihydropyridazin-3-one Formula: C21H21BrN4O4S MolecularWeight: 505.38484

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1CC(=O)N(N=C1C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O4S/c22-16-6-8-17(9-7-16)26-20(27)11-10-19(23-26)21(28)24-12-14-25(15-13-24)31(29,30)18-4-2-1-3-5-18/h1-9H,10-15H2