S-[[5-[(4-methoxyphenyl)carbonylsulfanylmethyl]-2-oxidanylidene-oxolan-3-yl]methyl] 4-methoxybenzenecarbothioate

Systemtic Name: S-[[5-[(4-methoxyphenyl)carbonylsulfanylmethyl]-2-oxidanylidene-oxolan-3-yl]methyl] 4-methoxybenzenecarbothioate Openeye Name: S-[[5-[(4-methoxybenzoyl)sulfanylmethyl]-2-oxo-tetrahydrofuran-3-yl]methyl] 4-methoxybenzenecarbothioate CAS Name: 4-methoxybenzenecarbothioic acid S-[[5-[[[(4-methoxyphenyl)-oxomethyl]thio]methyl]-2-oxo-3-oxolanyl]methyl] ester IUPAC Name: S-[[5-[(4-methoxybenzoyl)sulfanylmethyl]-2-oxooxolan-3-yl]methyl] 4-methoxybenzenecarbothioate Traditional Name: 4-methoxythiobenzoic acid S-[[2-keto-5-[(p-anisoylthio)methyl]tetrahydrofuran-3-yl]methyl] ester Formula: C22H22O6S2 MolecularWeight: 446.53648

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)SCC2CC(OC2=O)CSC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)SCC2CC(OC2=O)CSC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H22O6S2/c1-26-17-7-3-14(4-8-17)21(24)29-12-16-11-19(28-20(16)23)13-30-22(25)15-5-9-18(27-2)10-6-15/h3-10,16,19H,11-13H2,1-2H3