6,7-bis(fluoranyl)-4-oxidanylidene-1-(1,2,3-thiadiazol-4-ylmethyl)quinoline-3-carboxylic acid

Systemtic Name: 6,7-bis(fluoranyl)-4-oxidanylidene-1-(1,2,3-thiadiazol-4-ylmethyl)quinoline-3-carboxylic acid Openeye Name: 6,7-difluoro-4-oxo-1-(thiadiazol-4-ylmethyl)quinoline-3-carboxylic acid CAS Name: 6,7-difluoro-4-oxo-1-(4-thiadiazolylmethyl)-3-quinolinecarboxylic acid IUPAC Name: 6,7-difluoro-4-oxo-1-(thiadiazol-4-ylmethyl)quinoline-3-carboxylic acid Traditional Name: 6,7-difluoro-4-keto-1-(thiadiazol-4-ylmethyl)quinoline-3-carboxylic acid Formula: C13H7F2N3O3S MolecularWeight: 323.274786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=CC(=C1F)F)N(C=C(C2=O)C(=O)O)CC3=CSN=N3

Isomeric SMILES

C1=C2C(=CC(=C1F)F)N(C=C(C2=O)C(=O)O)CC3=CSN=N3

InChI

InChI=1S/C13H7F2N3O3S/c14-9-1-7-11(2-10(9)15)18(3-6-5-22-17-16-6)4-8(12(7)19)13(20)21/h1-2,4-5H,3H2,(H,20,21)