4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-1,3-thiazole-2-carboxylic acid

Systemtic Name: 4-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(5-phenyltetrazol-2-yl)methyl]thiazole-2-carboxylic acid CAS Name: 4-[(5-phenyl-2-tetrazolyl)methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(5-phenyltetrazol-2-yl)methyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[(5-phenyltetrazol-2-yl)methyl]thiazole-2-carboxylic acid Formula: C12H9N5O2S MolecularWeight: 287.29716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(N=N2)CC3=CSC(=N3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NN(N=N2)CC3=CSC(=N3)C(=O)O

InChI

InChI=1S/C12H9N5O2S/c18-12(19)11-13-9(7-20-11)6-17-15-10(14-16-17)8-4-2-1-3-5-8/h1-5,7H,6H2,(H,18,19)