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

Systemtic Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-fluorophenyl)pyridazin-3-one Openeye Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-fluorophenyl)pyridazin-3-one CAS Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-fluorophenyl)-3-pyridazinone IUPAC Name: 6-(4-ethylsulfonyl-1,4-diazepan-1-yl)-2-(4-fluorophenyl)pyridazin-3-one Traditional Name: 6-(4-esyl-1,4-diazepan-1-yl)-2-(4-fluorophenyl)pyridazin-3-one Formula: C17H21FN4O3S MolecularWeight: 380.437043

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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)F

Isomeric SMILES

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

InChI

InChI=1S/C17H21FN4O3S/c1-2-26(24,25)21-11-3-10-20(12-13-21)16-8-9-17(23)22(19-16)15-6-4-14(18)5-7-15/h4-9H,2-3,10-13H2,1H3