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

Systemtic Name: 2-(3-methylphenyl)-6-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-1,4-dihydropyridazin-3-one Openeye Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-(m-tolyl)-1,4-dihydropyridazin-3-one CAS Name: 6-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-2-(3-methylphenyl)-1,4-dihydropyridazin-3-one IUPAC Name: 6-[4-(benzenesulfonyl)piperazine-1-carbonyl]-2-(3-methylphenyl)-1,4-dihydropyridazin-3-one Traditional Name: 6-(4-besylpiperazine-1-carbonyl)-2-(m-tolyl)-1,4-dihydropyridazin-3-one Formula: C22H24N4O4S MolecularWeight: 440.51536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24N4O4S/c1-17-6-5-7-18(16-17)26-21(27)11-10-20(23-26)22(28)24-12-14-25(15-13-24)31(29,30)19-8-3-2-4-9-19/h2-10,16,23H,11-15H2,1H3