N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide

Systemtic Name: N-(6-fluoranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(2-fluorophenyl)-6-methyl-4-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(2-fluorophenyl)-N-(6-fluorothiochroman-4-yl)-6-methyl-4-oxo-pyridazine-3-carboxamide CAS Name: N-(6-fluoro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-(2-fluorophenyl)-6-methyl-4-oxo-3-pyridazinecarboxamide IUPAC Name: N-(6-fluoro-3,4-dihydro-2H-thiochromen-4-yl)-1-(2-fluorophenyl)-6-methyl-4-oxopyridazine-3-carboxamide Traditional Name: 1-(2-fluorophenyl)-N-(6-fluorothiochroman-4-yl)-4-keto-6-methyl-pyridazine-3-carboxamide Formula: C21H17F2N3O2S MolecularWeight: 413.440386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3CCSC4=C3C=C(C=C4)F

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2F)C(=O)NC3CCSC4=C3C=C(C=C4)F

InChI

InChI=1S/C21H17F2N3O2S/c1-12-10-18(27)20(25-26(12)17-5-3-2-4-15(17)23)21(28)24-16-8-9-29-19-7-6-13(22)11-14(16)19/h2-7,10-11,16H,8-9H2,1H3,(H,24,28)