1-(1,3-benzothiazol-2-yl)-5-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-5-methyl-pyrazole-3-carboxylic acid Openeye Name: 1-(1,3-benzothiazol-2-yl)-5-methyl-pyrazole-3-carboxylic acid CAS Name: 1-(1,3-benzothiazol-2-yl)-5-methyl-3-pyrazolecarboxylic acid IUPAC Name: 1-(1,3-benzothiazol-2-yl)-5-methylpyrazole-3-carboxylic acid Traditional Name: 1-(1,3-benzothiazol-2-yl)-5-methyl-pyrazole-3-carboxylic acid Formula: C12H9N3O2S MolecularWeight: 259.28376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NC3=CC=CC=C3S2)C(=O)O

Isomeric SMILES

CC1=CC(=NN1C2=NC3=CC=CC=C3S2)C(=O)O

InChI

InChI=1S/C12H9N3O2S/c1-7-6-9(11(16)17)14-15(7)12-13-8-4-2-3-5-10(8)18-12/h2-6H,1H3,(H,16,17)