4-(4-methoxyphenyl)sulfanyl-5-[4-(2-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one

Systemtic Name: 4-(4-methoxyphenyl)sulfanyl-5-[4-(2-methylphenyl)sulfonylpiperazin-1-yl]-2-phenyl-pyridazin-3-one Openeye Name: 4-(4-methoxyphenyl)sulfanyl-5-[4-(o-tolylsulfonyl)piperazin-1-yl]-2-phenyl-pyridazin-3-one CAS Name: 4-[(4-methoxyphenyl)thio]-5-[4-(2-methylphenyl)sulfonyl-1-piperazinyl]-2-phenyl-3-pyridazinone IUPAC Name: 4-(4-methoxyphenyl)sulfanyl-5-[4-(2-methylphenyl)sulfonylpiperazin-1-yl]-2-phenylpyridazin-3-one Traditional Name: 4-[(4-methoxyphenyl)thio]-5-[4-(o-tolylsulfonyl)piperazino]-2-phenyl-pyridazin-3-one Formula: C28H28N4O4S2 MolecularWeight: 548.67632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)SC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)N2CCN(CC2)C3=C(C(=O)N(N=C3)C4=CC=CC=C4)SC5=CC=C(C=C5)OC

InChI

InChI=1S/C28H28N4O4S2/c1-21-8-6-7-11-26(21)38(34,35)31-18-16-30(17-19-31)25-20-29-32(22-9-4-3-5-10-22)28(33)27(25)37-24-14-12-23(36-2)13-15-24/h3-15,20H,16-19H2,1-2H3