6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)pyridazin-3-one

Systemtic Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)pyridazin-3-one Openeye Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(p-tolyl)pyridazin-3-one CAS Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)-3-pyridazinone IUPAC Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-methylphenyl)pyridazin-3-one Traditional Name: 6-(4-esyl-1,4-diazepan-1-yl)-2-(p-tolyl)pyridazin-3-one Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1CCCN(CC1)C2=NN(C(=O)C=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCS(=O)(=O)N1CCCN(CC1)C2=NN(C(=O)C=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C18H24N4O3S/c1-3-26(24,25)21-12-4-11-20(13-14-21)17-9-10-18(23)22(19-17)16-7-5-15(2)6-8-16/h5-10H,3-4,11-14H2,1-2H3