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

Systemtic Name: 2-(4-bromophenyl)-6-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 2-(4-bromophenyl)-6-[4-(p-tolylsulfonyl)piperazine-1-carbonyl]-4,5-dihydropyridazin-3-one CAS Name: 2-(4-bromophenyl)-6-[[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-4,5-dihydropyridazin-3-one IUPAC Name: 2-(4-bromophenyl)-6-[4-(4-methylphenyl)sulfonylpiperazine-1-carbonyl]-4,5-dihydropyridazin-3-one Traditional Name: 2-(4-bromophenyl)-6-(4-tosylpiperazine-1-carbonyl)-4,5-dihydropyridazin-3-one Formula: C22H23BrN4O4S MolecularWeight: 519.41142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)CC3)C4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NN(C(=O)CC3)C4=CC=C(C=C4)Br

InChI

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