6-[[3,4-bis(fluoranyl)phenyl]methyl]-4-methyl-5-oxidanylidene-[1,3]thiazolo[5,4-b]pyridine-2-carboxylic acid

Systemtic Name: 6-[[3,4-bis(fluoranyl)phenyl]methyl]-4-methyl-5-oxidanylidene-[1,3]thiazolo[5,4-b]pyridine-2-carboxylic acid Openeye Name: 6-[(3,4-difluorophenyl)methyl]-4-methyl-5-oxo-thiazolo[5,4-b]pyridine-2-carboxylic acid CAS Name: 6-[(3,4-difluorophenyl)methyl]-4-methyl-5-oxo-2-thiazolo[5,4-b]pyridinecarboxylic acid IUPAC Name: 6-[(3,4-difluorophenyl)methyl]-4-methyl-5-oxo-[1,3]thiazolo[5,4-b]pyridine-2-carboxylic acid Traditional Name: 6-(3,4-difluorobenzyl)-5-keto-4-methyl-thiazolo[5,4-b]pyridine-2-carboxylic acid Formula: C15H10F2N2O3S MolecularWeight: 336.313306

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C1=O)CC3=CC(=C(C=C3)F)F)N=C(S2)C(=O)O

Isomeric SMILES

CN1C2=C(C=C(C1=O)CC3=CC(=C(C=C3)F)F)N=C(S2)C(=O)O

InChI

InChI=1S/C15H10F2N2O3S/c1-19-13(20)8(4-7-2-3-9(16)10(17)5-7)6-11-14(19)23-12(18-11)15(21)22/h2-3,5-6H,4H2,1H3,(H,21,22)