5-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-methyl-1-(4-phenyl-1,3-thiazol-2-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-methyl-1-(4-phenylthiazol-2-yl)triazole-4-carboxylic acid CAS Name: 5-methyl-1-(4-phenyl-2-thiazolyl)-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-(4-phenyl-1,3-thiazol-2-yl)triazole-4-carboxylic acid Traditional Name: 5-methyl-1-(4-phenylthiazol-2-yl)triazole-4-carboxylic acid Formula: C13H10N4O2S MolecularWeight: 286.3091

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=NC(=CS2)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=NC(=CS2)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C13H10N4O2S/c1-8-11(12(18)19)15-16-17(8)13-14-10(7-20-13)9-5-3-2-4-6-9/h2-7H,1H3,(H,18,19)