methyl 2-[2-[(4-chlorophenyl)methylsulfanyl]cyclohexyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-[(4-chlorophenyl)methylsulfanyl]cyclohexyl]sulfanylethanoate Openeye Name: methyl 2-[2-[(4-chlorophenyl)methylsulfanyl]cyclohexyl]sulfanylacetate CAS Name: 2-[[2-[(4-chlorophenyl)methylthio]cyclohexyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-[(4-chlorophenyl)methylsulfanyl]cyclohexyl]sulfanylacetate Traditional Name: 2-[[2-[(4-chlorobenzyl)thio]cyclohexyl]thio]acetic acid methyl ester Formula: C16H21ClO2S2 MolecularWeight: 344.91974

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1CCCCC1SCC2=CC=C(C=C2)Cl

Isomeric SMILES

COC(=O)CSC1CCCCC1SCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C16H21ClO2S2/c1-19-16(18)11-21-15-5-3-2-4-14(15)20-10-12-6-8-13(17)9-7-12/h6-9,14-15H,2-5,10-11H2,1H3