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

Systemtic Name: 2-(3-methylphenyl)-6-[4-(phenylmethyl)sulfonylpiperazin-1-yl]carbonyl-4,5-dihydropyridazin-3-one Openeye Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-(m-tolyl)-4,5-dihydropyridazin-3-one CAS Name: 2-(3-methylphenyl)-6-[oxo-[4-(phenylmethyl)sulfonyl-1-piperazinyl]methyl]-4,5-dihydropyridazin-3-one IUPAC Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-(3-methylphenyl)-4,5-dihydropyridazin-3-one Traditional Name: 6-(4-benzylsulfonylpiperazine-1-carbonyl)-2-(m-tolyl)-4,5-dihydropyridazin-3-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4O4S/c1-18-6-5-9-20(16-18)27-22(28)11-10-21(24-27)23(29)25-12-14-26(15-13-25)32(30,31)17-19-7-3-2-4-8-19/h2-9,16H,10-15,17H2,1H3