5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxylic acid CAS Name: 5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxylic acid Traditional Name: 5-methyl-1-(2-methyl-1,3-benzothiazol-6-yl)triazole-4-carboxylic acid Formula: C12H10N4O2S MolecularWeight: 274.2984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=CC3=C(C=C2)N=C(S3)C)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=CC3=C(C=C2)N=C(S3)C)C(=O)O

InChI

InChI=1S/C12H10N4O2S/c1-6-11(12(17)18)14-15-16(6)8-3-4-9-10(5-8)19-7(2)13-9/h3-5H,1-2H3,(H,17,18)