[2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-(5-methylthiophen-2-yl)-2-oxidanylidene-ethyl] (2R)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-(5-methyl-2-thienyl)-2-oxo-ethyl] (2R)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2R)-2-(carbamoylamino)-4-(methylthio)butanoic acid [2-(5-methyl-2-thiophenyl)-2-oxoethyl] ester IUPAC Name: [2-(5-methylthiophen-2-yl)-2-oxoethyl] (2R)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2R)-4-(methylthio)-2-ureido-butyric acid [2-keto-2-(5-methyl-2-thienyl)ethyl] ester Formula: C13H18N2O4S2 MolecularWeight: 330.42302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)COC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

CC1=CC=C(S1)C(=O)COC(=O)[C@@H](CCSC)NC(=O)N

InChI

InChI=1S/C13H18N2O4S2/c1-8-3-4-11(21-8)10(16)7-19-12(17)9(5-6-20-2)15-13(14)18/h3-4,9H,5-7H2,1-2H3,(H3,14,15,18)/t9-/m1/s1