5-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]methyl]-3-methyl-1H-pyridazin-6-one

Systemtic Name: 5-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]methyl]-3-methyl-1H-pyridazin-6-one Openeye Name: 5-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]methyl]-3-methyl-1H-pyridazin-6-one CAS Name: 5-[[4-[[4-(2-methoxyphenyl)-1-piperazinyl]sulfonyl]phenyl]methyl]-3-methyl-1H-pyridazin-6-one IUPAC Name: 5-[[4-[4-(2-methoxyphenyl)piperazin-1-yl]sulfonylphenyl]methyl]-3-methyl-1H-pyridazin-6-one Traditional Name: 5-[4-[4-(2-methoxyphenyl)piperazino]sulfonylbenzyl]-3-methyl-1H-pyridazin-6-one Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=O)C(=C1)CC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OC

Isomeric SMILES

CC1=NNC(=O)C(=C1)CC2=CC=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4OC

InChI

InChI=1S/C23H26N4O4S/c1-17-15-19(23(28)25-24-17)16-18-7-9-20(10-8-18)32(29,30)27-13-11-26(12-14-27)21-5-3-4-6-22(21)31-2/h3-10,15H,11-14,16H2,1-2H3,(H,25,28)