methyl 2-[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-4-(2-methylpropyl)thiophene-3-carboxylate

Systemtic Name: methyl 2-[[1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazin-3-yl]carbonylamino]-4-(2-methylpropyl)thiophene-3-carboxylate Openeye Name: methyl 2-[[1-(2-fluorophenyl)-6-methyl-4-oxo-pyridazine-3-carbonyl]amino]-4-isobutyl-thiophene-3-carboxylate CAS Name: 2-[[[1-(2-fluorophenyl)-6-methyl-4-oxo-3-pyridazinyl]-oxomethyl]amino]-4-(2-methylpropyl)-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carbonyl]amino]-4-(2-methylpropyl)thiophene-3-carboxylate Traditional Name: 2-[[1-(2-fluorophenyl)-4-keto-6-methyl-pyridazine-3-carbonyl]amino]-4-isobutyl-thiophene-3-carboxylic acid methyl ester Formula: C22H22FN3O4S MolecularWeight: 443.491183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3=C(C(=CS3)CC(C)C)C(=O)OC

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3=C(C(=CS3)CC(C)C)C(=O)OC

InChI

InChI=1S/C22H22FN3O4S/c1-12(2)9-14-11-31-21(18(14)22(29)30-4)24-20(28)19-17(27)10-13(3)26(25-19)16-8-6-5-7-15(16)23/h5-8,10-12H,9H2,1-4H3,(H,24,28)