[2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-(4-ethylphenyl)-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-(4-ethylphenyl)-2-oxo-ethyl] 2-(furan-2-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4-(methylthio)butanoic acid [2-(4-ethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-ethylphenyl)-2-oxoethyl] 2-(furan-2-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(2-furoylamino)-4-(methylthio)butyric acid [2-(4-ethylphenyl)-2-keto-ethyl] ester Formula: C20H23NO5S MolecularWeight: 389.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)COC(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)COC(=O)C(CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C20H23NO5S/c1-3-14-6-8-15(9-7-14)17(22)13-26-20(24)16(10-12-27-2)21-19(23)18-5-4-11-25-18/h4-9,11,16H,3,10,12-13H2,1-2H3,(H,21,23)