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

Systemtic Name: 3-[(3-methyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-ylidene)amino]benzoic acid Openeye Name: 3-[[3-methyl-5-(2-pyridyl)-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid CAS Name: 3-[[3-methyl-5-(2-pyridinyl)-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid IUPAC Name: 3-[(3-methyl-5-pyridin-2-yl-1,3,4-thiadiazol-2-ylidene)amino]benzoic acid Traditional Name: 3-[[3-methyl-5-(2-pyridyl)-1,3,4-thiadiazol-2-ylidene]amino]benzoic acid Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=CC=CC(=C2)C(=O)O)SC(=N1)C3=CC=CC=N3

Isomeric SMILES

CN1C(=NC2=CC=CC(=C2)C(=O)O)SC(=N1)C3=CC=CC=N3

InChI

InChI=1S/C15H12N4O2S/c1-19-15(17-11-6-4-5-10(9-11)14(20)21)22-13(18-19)12-7-2-3-8-16-12/h2-9H,1H3,(H,20,21)