ethyl 4-(4-methoxyphenyl)-2-sulfanyl-3-sulfanylidene-butanoate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-sulfanyl-3-sulfanylidene-butanoate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-sulfanyl-3-thioxo-butanoate CAS Name: 2-mercapto-4-(4-methoxyphenyl)-3-sulfanylidenebutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-sulfanyl-3-sulfanylidenebutanoate Traditional Name: 2-mercapto-4-(4-methoxyphenyl)-3-thioxo-butyric acid ethyl ester Formula: C13H16O3S2 MolecularWeight: 284.39434

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=S)CC1=CC=C(C=C1)OC)S

Isomeric SMILES

CCOC(=O)C(C(=S)CC1=CC=C(C=C1)OC)S

InChI

InChI=1S/C13H16O3S2/c1-3-16-13(14)12(18)11(17)8-9-4-6-10(15-2)7-5-9/h4-7,12,18H,3,8H2,1-2H3