2-[2-(5-bromanylthiophen-2-yl)thian-2-yl]ethanoic acid

Systemtic Name: 2-[2-(5-bromanylthiophen-2-yl)thian-2-yl]ethanoic acid Openeye Name: 2-[2-(5-bromo-2-thienyl)tetrahydrothiopyran-2-yl]acetic acid CAS Name: 2-[2-(5-bromo-2-thiophenyl)-2-thianyl]acetic acid IUPAC Name: 2-[2-(5-bromothiophen-2-yl)thian-2-yl]acetic acid Traditional Name: 2-[2-(5-bromo-2-thienyl)tetrahydrothiopyran-2-yl]acetic acid Formula: C11H13BrO2S2 MolecularWeight: 321.25372

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Descriptors Computed from Structure

Canonical SMILES:

C1CCSC(C1)(CC(=O)O)C2=CC=C(S2)Br

Isomeric SMILES

C1CCSC(C1)(CC(=O)O)C2=CC=C(S2)Br

InChI

InChI=1S/C11H13BrO2S2/c12-9-4-3-8(16-9)11(7-10(13)14)5-1-2-6-15-11/h3-4H,1-2,5-7H2,(H,13,14)