2-[2-(3-bromophenyl)sulfanylcyclohexyl]sulfanylethanoic acid

Systemtic Name: 2-[2-(3-bromophenyl)sulfanylcyclohexyl]sulfanylethanoic acid Openeye Name: 2-[2-(3-bromophenyl)sulfanylcyclohexyl]sulfanylacetic acid CAS Name: 2-[[2-[(3-bromophenyl)thio]cyclohexyl]thio]acetic acid IUPAC Name: 2-[2-(3-bromophenyl)sulfanylcyclohexyl]sulfanylacetic acid Traditional Name: 2-[[2-[(3-bromophenyl)thio]cyclohexyl]thio]acetic acid Formula: C14H17BrO2S2 MolecularWeight: 361.31758

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)SCC(=O)O)SC2=CC(=CC=C2)Br

Isomeric SMILES

C1CCC(C(C1)SCC(=O)O)SC2=CC(=CC=C2)Br

InChI

InChI=1S/C14H17BrO2S2/c15-10-4-3-5-11(8-10)19-13-7-2-1-6-12(13)18-9-14(16)17/h3-5,8,12-13H,1-2,6-7,9H2,(H,16,17)