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

Systemtic Name: 7-[[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-6-fluoranyl-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 7-[[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 7-[[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]thio]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 7-[[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]sulfanyl]-6-fluoro-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 7-[[5-(4-cyanophenyl)-1,3,4-thiadiazol-2-yl]thio]-6-fluoro-4-keto-1H-quinoline-3-carboxylic acid Formula: C19H9FN4O3S2 MolecularWeight: 424.428163

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=NN=C(S2)SC3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=NN=C(S2)SC3=C(C=C4C(=C3)NC=C(C4=O)C(=O)O)F

InChI

InChI=1S/C19H9FN4O3S2/c20-13-5-11-14(22-8-12(16(11)25)18(26)27)6-15(13)28-19-24-23-17(29-19)10-3-1-9(7-21)2-4-10/h1-6,8H,(H,22,25)(H,26,27)