1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: 1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(2-fluorophenyl)-6-methyl-4-oxo-N-[2-(p-tolylsulfanyl)ethyl]pyridazine-3-carboxamide CAS Name: 1-(2-fluorophenyl)-6-methyl-N-[2-[(4-methylphenyl)thio]ethyl]-4-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(2-fluorophenyl)-6-methyl-N-[2-(4-methylphenyl)sulfanylethyl]-4-oxopyridazine-3-carboxamide Traditional Name: 1-(2-fluorophenyl)-4-keto-6-methyl-N-[2-(p-tolylthio)ethyl]pyridazine-3-carboxamide Formula: C21H20FN3O2S MolecularWeight: 397.465803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3F

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)C2=NN(C(=CC2=O)C)C3=CC=CC=C3F

InChI

InChI=1S/C21H20FN3O2S/c1-14-7-9-16(10-8-14)28-12-11-23-21(27)20-19(26)13-15(2)25(24-20)18-6-4-3-5-17(18)22/h3-10,13H,11-12H2,1-2H3,(H,23,27)