3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1,2,4-thiadiazole-5-carboxylic acid Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NSC(=N2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NSC(=N2)C(=O)O

InChI

InChI=1S/C13H14N2O2S/c1-13(2,3)9-6-4-8(5-7-9)10-14-11(12(16)17)18-15-10/h4-7H,1-3H3,(H,16,17)