5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluoranyl-benzoic acid Openeye Name: 5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluoro-benzoic acid CAS Name: 5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluorobenzoic acid IUPAC Name: 5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluorobenzoic acid Traditional Name: 5-[[5-(4-cyanophenyl)-3-methyl-1,3,4-thiadiazol-2-ylidene]amino]-2-fluoro-benzoic acid Formula: C17H11FN4O2S MolecularWeight: 354.358243

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC(=C(C=C2)F)C(=O)O)SC(=N1)C3=CC=C(C=C3)C#N

Isomeric SMILES

CN1C(=NC2=CC(=C(C=C2)F)C(=O)O)SC(=N1)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H11FN4O2S/c1-22-17(20-12-6-7-14(18)13(8-12)16(23)24)25-15(21-22)11-4-2-10(9-19)3-5-11/h2-8H,1H3,(H,23,24)