methyl 2-[2-methanoyl-1-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-3-phenyl-propyl]sulfanylethanoate

Systemtic Name: methyl 2-[2-methanoyl-1-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-3-phenyl-propyl]sulfanylethanoate Openeye Name: methyl 2-[2-benzyl-1-(2-methoxy-2-oxo-ethyl)sulfanyl-3-oxo-propyl]sulfanylacetate CAS Name: 2-[[2-formyl-1-[(2-methoxy-2-oxoethyl)thio]-3-phenylpropyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[2-benzyl-1-(2-methoxy-2-oxoethyl)sulfanyl-3-oxopropyl]sulfanylacetate Traditional Name: 2-[[2-benzyl-3-keto-1-[(2-keto-2-methoxy-ethyl)thio]propyl]thio]acetic acid methyl ester Formula: C16H20O5S2 MolecularWeight: 356.457

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC(C(CC1=CC=CC=C1)C=O)SCC(=O)OC

Isomeric SMILES

COC(=O)CSC(C(CC1=CC=CC=C1)C=O)SCC(=O)OC

InChI

InChI=1S/C16H20O5S2/c1-20-14(18)10-22-16(23-11-15(19)21-2)13(9-17)8-12-6-4-3-5-7-12/h3-7,9,13,16H,8,10-11H2,1-2H3