methyl 4-(3-bromanyl-4-fluoranyl-phenyl)-2-methyl-5-oxidanylidene-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylate

Systemtic Name: methyl 4-(3-bromanyl-4-fluoranyl-phenyl)-2-methyl-5-oxidanylidene-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylate Openeye Name: methyl 4-(3-bromo-4-fluoro-phenyl)-2-methyl-5-oxo-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylate CAS Name: 4-(3-bromo-4-fluorophenyl)-2-methyl-5-oxo-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(3-bromo-4-fluorophenyl)-2-methyl-5-oxo-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(3-bromo-4-fluoro-phenyl)-5-keto-2-methyl-4,8-dihydro-1H-thiopyrano[3,4-b]pyridine-3-carboxylic acid methyl ester Formula: C17H15BrFNO3S MolecularWeight: 412.273303

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CSCC2=O)C3=CC(=C(C=C3)F)Br)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CSCC2=O)C3=CC(=C(C=C3)F)Br)C(=O)OC

InChI

InChI=1S/C17H15BrFNO3S/c1-8-14(17(22)23-2)15(9-3-4-11(19)10(18)5-9)16-12(20-8)6-24-7-13(16)21/h3-5,15,20H,6-7H2,1-2H3