6-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)pyridazin-3-one

Systemtic Name: 6-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)pyridazin-3-one Openeye Name: 6-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-2-(p-tolyl)pyridazin-3-one CAS Name: 6-[4-(1H-imidazol-5-ylsulfonyl)-1-piperazinyl]-2-(4-methylphenyl)-3-pyridazinone IUPAC Name: 6-[4-(1H-imidazol-5-ylsulfonyl)piperazin-1-yl]-2-(4-methylphenyl)pyridazin-3-one Traditional Name: 6-[4-(1H-imidazol-5-ylsulfonyl)piperazino]-2-(p-tolyl)pyridazin-3-one Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)S(=O)(=O)C4=CN=CN4

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C=CC(=N2)N3CCN(CC3)S(=O)(=O)C4=CN=CN4

InChI

InChI=1S/C18H20N6O3S/c1-14-2-4-15(5-3-14)24-18(25)7-6-16(21-24)22-8-10-23(11-9-22)28(26,27)17-12-19-13-20-17/h2-7,12-13H,8-11H2,1H3,(H,19,20)