(2S)-2-[(2-ethoxycarbonylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(2-ethoxycarbonylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(2-ethoxycarbonylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(2-ethoxycarbonylanilino)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(2-ethoxycarbonylphenyl)carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2-carbethoxyphenyl)carbamoylamino]-4-(methylthio)butyrate Formula: C15H19N2O5S- MolecularWeight: 339.38676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C15H20N2O5S/c1-3-22-14(20)10-6-4-5-7-11(10)16-15(21)17-12(13(18)19)8-9-23-2/h4-7,12H,3,8-9H2,1-2H3,(H,18,19)(H2,16,17,21)/p-1/t12-/m0/s1