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

Systemtic Name: [2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl] 2-(furan-2-ylcarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-(2-methylanilino)-2-oxo-ethyl] 2-(furan-2-carbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-4-(methylthio)butanoic acid [2-(2-methylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methylanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)-4-methylsulfanylbutanoate Traditional Name: 2-(2-furoylamino)-4-(methylthio)butyric acid [2-keto-2-(o-toluidino)ethyl] ester Formula: C19H22N2O5S MolecularWeight: 390.45338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)COC(=O)C(CCSC)NC(=O)C2=CC=CO2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)COC(=O)C(CCSC)NC(=O)C2=CC=CO2

InChI

InChI=1S/C19H22N2O5S/c1-13-6-3-4-7-14(13)20-17(22)12-26-19(24)15(9-11-27-2)21-18(23)16-8-5-10-25-16/h3-8,10,15H,9,11-12H2,1-2H3,(H,20,22)(H,21,23)