[2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate

Systemtic Name: [2-(4-methylsulfanylphenyl)-2-oxidanylidene-ethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Openeye Name: [2-(4-methylsulfanylphenyl)-2-oxo-ethyl] 2-(4,5-dihydrothiazol-2-ylsulfanylmethyl)benzoate CAS Name: 2-[(4,5-dihydrothiazol-2-ylthio)methyl]benzoic acid [2-[4-(methylthio)phenyl]-2-oxoethyl] ester IUPAC Name: [2-(4-methylsulfanylphenyl)-2-oxoethyl] 2-(4,5-dihydro-1,3-thiazol-2-ylsulfanylmethyl)benzoate Traditional Name: 2-[(2-thiazolin-2-ylthio)methyl]benzoic acid [2-keto-2-[4-(methylthio)phenyl]ethyl] ester Formula: C20H19NO3S3 MolecularWeight: 417.56476

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2CSC3=NCCS3

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2CSC3=NCCS3

InChI

InChI=1S/C20H19NO3S3/c1-25-16-8-6-14(7-9-16)18(22)12-24-19(23)17-5-3-2-4-15(17)13-27-20-21-10-11-26-20/h2-9H,10-13H2,1H3