2-[(3-tert-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)sulfanyl]thiazole-5-carboxylic acid CAS Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)thio]-5-thiazolecarboxylic acid IUPAC Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)sulfanyl]-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(3-tert-butyl-1,2,4-triazol-1-yl)thio]thiazole-5-carboxylic acid Formula: C10H12N4O2S2 MolecularWeight: 284.35788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C=N1)SC2=NC=C(S2)C(=O)O

Isomeric SMILES

CC(C)(C)C1=NN(C=N1)SC2=NC=C(S2)C(=O)O

InChI

InChI=1S/C10H12N4O2S2/c1-10(2,3)8-12-5-14(13-8)18-9-11-4-6(17-9)7(15)16/h4-5H,1-3H3,(H,15,16)