[2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (2S)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate

Systemtic Name: [2-(4-methoxyphenyl)-2-oxidanylidene-ethyl] (2S)-2-(aminocarbonylamino)-4-methylsulfanyl-butanoate Openeye Name: [2-(4-methoxyphenyl)-2-oxo-ethyl] (2S)-4-methylsulfanyl-2-ureido-butanoate CAS Name: (2S)-2-(carbamoylamino)-4-(methylthio)butanoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methoxyphenyl)-2-oxoethyl] (2S)-2-(carbamoylamino)-4-methylsulfanylbutanoate Traditional Name: (2S)-4-(methylthio)-2-ureido-butyric acid [2-keto-2-(4-methoxyphenyl)ethyl] ester Formula: C15H20N2O5S MolecularWeight: 340.3947

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)COC(=O)C(CCSC)NC(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)COC(=O)[C@H](CCSC)NC(=O)N

InChI

InChI=1S/C15H20N2O5S/c1-21-11-5-3-10(4-6-11)13(18)9-22-14(19)12(7-8-23-2)17-15(16)20/h3-6,12H,7-9H2,1-2H3,(H3,16,17,20)/t12-/m0/s1