4-[[4-(6-chloranylpyridazin-3-yl)piperazin-1-yl]methyl]-1-(4-methylphenyl)sulfonyl-3-oxidanyl-pyridin-2-one

Systemtic Name: 4-[[4-(6-chloranylpyridazin-3-yl)piperazin-1-yl]methyl]-1-(4-methylphenyl)sulfonyl-3-oxidanyl-pyridin-2-one Openeye Name: 4-[[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl]-3-hydroxy-1-(p-tolylsulfonyl)pyridin-2-one CAS Name: 4-[[4-(6-chloro-3-pyridazinyl)-1-piperazinyl]methyl]-3-hydroxy-1-(4-methylphenyl)sulfonyl-2-pyridinone IUPAC Name: 4-[[4-(6-chloropyridazin-3-yl)piperazin-1-yl]methyl]-3-hydroxy-1-(4-methylphenyl)sulfonylpyridin-2-one Traditional Name: 4-[[4-(6-chloropyridazin-3-yl)piperazino]methyl]-3-hydroxy-1-tosyl-2-pyridone Formula: C21H22ClN5O4S MolecularWeight: 475.94848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C(C2=O)O)CN3CCN(CC3)C4=NN=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C(C2=O)O)CN3CCN(CC3)C4=NN=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN5O4S/c1-15-2-4-17(5-3-15)32(30,31)27-9-8-16(20(28)21(27)29)14-25-10-12-26(13-11-25)19-7-6-18(22)23-24-19/h2-9,28H,10-14H2,1H3