(2S)-2-[[methyl(phenyl)carbamoyl]amino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[[methyl(phenyl)carbamoyl]amino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[methyl(phenyl)carbamoyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(N-methylanilino)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[methyl(phenyl)carbamoyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[methyl(phenyl)carbamoyl]amino]-4-(methylthio)butyrate Formula: C13H17N2O3S- MolecularWeight: 281.35068

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CN(C1=CC=CC=C1)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C13H18N2O3S/c1-15(10-6-4-3-5-7-10)13(18)14-11(12(16)17)8-9-19-2/h3-7,11H,8-9H2,1-2H3,(H,14,18)(H,16,17)/p-1/t11-/m0/s1