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

Systemtic Name: 2-[5-[(5-bromanyl-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]ethanoic acid Openeye Name: 2-[5-(5-bromo-4-tert-butyl-thiazol-2-yl)sulfanyl-1,3,4-thiadiazol-2-yl]acetic acid CAS Name: 2-[5-[(5-bromo-4-tert-butyl-2-thiazolyl)thio]-1,3,4-thiadiazol-2-yl]acetic acid IUPAC Name: 2-[5-[(5-bromo-4-tert-butyl-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]acetic acid Traditional Name: 2-[5-[(5-bromo-4-tert-butyl-thiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]acetic acid Formula: C11H12BrN3O2S3 MolecularWeight: 394.33088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CC(=O)O)Br

Isomeric SMILES

CC(C)(C)C1=C(SC(=N1)SC2=NN=C(S2)CC(=O)O)Br

InChI

InChI=1S/C11H12BrN3O2S3/c1-11(2,3)7-8(12)19-9(13-7)20-10-15-14-5(18-10)4-6(16)17/h4H2,1-3H3,(H,16,17)