[3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxylate

Systemtic Name: [3-(3-fluoranyl-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxidanylidene-1-phenyl-4,5-dihydropyridazine-3-carboxylate Openeye Name: [3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylate CAS Name: 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylic acid [3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-fluoro-4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 6-oxo-1-phenyl-4,5-dihydropyridazine-3-carboxylate Traditional Name: 6-keto-1-phenyl-4,5-dihydropyridazine-3-carboxylic acid [3-(3-fluoro-4-methyl-phenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C21H17FN4O4 MolecularWeight: 408.382483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4)F

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NOC(=N2)COC(=O)C3=NN(C(=O)CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C21H17FN4O4/c1-13-7-8-14(11-16(13)22)20-23-18(30-25-20)12-29-21(28)17-9-10-19(27)26(24-17)15-5-3-2-4-6-15/h2-8,11H,9-10,12H2,1H3