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

Systemtic Name: (2S)-2-[(4-ethanoylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(4-acetylphenyl)carbamoylamino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(4-acetylanilino)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(4-acetylphenyl)carbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(4-acetylphenyl)carbamoylamino]-4-(methylthio)butyrate Formula: C14H17N2O4S- MolecularWeight: 309.36078

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O4S/c1-9(17)10-3-5-11(6-4-10)15-14(20)16-12(13(18)19)7-8-21-2/h3-6,12H,7-8H2,1-2H3,(H,18,19)(H2,15,16,20)/p-1/t12-/m0/s1