6-fluoranyl-4-oxidanylidene-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1H-quinoline-3-carboxylic acid

Systemtic Name: 6-fluoranyl-4-oxidanylidene-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1H-quinoline-3-carboxylic acid Openeye Name: 6-fluoro-4-oxo-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1H-quinoline-3-carboxylic acid CAS Name: 6-fluoro-4-oxo-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]-1H-quinoline-3-carboxylic acid IUPAC Name: 6-fluoro-4-oxo-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)sulfanyl]-1H-quinoline-3-carboxylic acid Traditional Name: 6-fluoro-4-keto-7-[(5-phenyl-1,3,4-thiadiazol-2-yl)thio]-1H-quinoline-3-carboxylic acid Formula: C18H10FN3O3S2 MolecularWeight: 399.418703

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(S2)SC3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(S2)SC3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

InChI

InChI=1S/C18H10FN3O3S2/c19-12-6-10-13(20-8-11(15(10)23)17(24)25)7-14(12)26-18-22-21-16(27-18)9-4-2-1-3-5-9/h1-8H,(H,20,23)(H,24,25)