3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one Openeye Name: 3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one CAS Name: 3-[3-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]-4,5-dimethylphenyl]-1H-pyridazin-6-one IUPAC Name: 3-[3-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-4,5-dimethylphenyl]-1H-pyridazin-6-one Traditional Name: 3-[3-[4-(4-methoxyphenyl)piperazino]sulfonyl-4,5-dimethyl-phenyl]-1H-pyridazin-6-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C2=NNC(=O)C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C2=NNC(=O)C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C23H26N4O4S/c1-16-14-18(21-8-9-23(28)25-24-21)15-22(17(16)2)32(29,30)27-12-10-26(11-13-27)19-4-6-20(31-3)7-5-19/h4-9,14-15H,10-13H2,1-3H3,(H,25,28)