2-[(4-tert-butyl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid

Systemtic Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid Openeye Name: 2-[(4-tert-butylthiazol-2-yl)methylsulfanyl]benzoic acid CAS Name: 2-[(4-tert-butyl-2-thiazolyl)methylthio]benzoic acid IUPAC Name: 2-[(4-tert-butyl-1,3-thiazol-2-yl)methylsulfanyl]benzoic acid Traditional Name: 2-[(4-tert-butylthiazol-2-yl)methylthio]benzoic acid Formula: C15H17NO2S2 MolecularWeight: 307.43098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CSC(=N1)CSC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C)(C)C1=CSC(=N1)CSC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C15H17NO2S2/c1-15(2,3)12-8-20-13(16-12)9-19-11-7-5-4-6-10(11)14(17)18/h4-8H,9H2,1-3H3,(H,17,18)