2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid

Systemtic Name: 2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]ethanoic acid Openeye Name: 2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]thiazol-4-yl]acetic acid CAS Name: 2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)thio]-4-thiazolyl]acetic acid IUPAC Name: 2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-1,3-thiazol-4-yl]acetic acid Traditional Name: 2-[2-[(5-tert-butyl-4-phenyl-1,2,4-triazol-3-yl)thio]thiazol-4-yl]acetic acid Formula: C17H18N4O2S2 MolecularWeight: 374.48042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN=C(N1C2=CC=CC=C2)SC3=NC(=CS3)CC(=O)O

Isomeric SMILES

CC(C)(C)C1=NN=C(N1C2=CC=CC=C2)SC3=NC(=CS3)CC(=O)O

InChI

InChI=1S/C17H18N4O2S2/c1-17(2,3)14-19-20-15(21(14)12-7-5-4-6-8-12)25-16-18-11(10-24-16)9-13(22)23/h4-8,10H,9H2,1-3H3,(H,22,23)