(2S)-2-[(2-methylphenyl)methylcarbamoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(2-methylphenyl)methylcarbamoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-4-methylsulfanyl-2-(o-tolylmethylcarbamoylamino)butanoate CAS Name: (2S)-2-[[[(2-methylphenyl)methylamino]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(2-methylphenyl)methylcarbamoylamino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(2-methylbenzyl)carbamoylamino]-4-(methylthio)butyrate Formula: C14H19N2O3S- MolecularWeight: 295.37726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C14H20N2O3S/c1-10-5-3-4-6-11(10)9-15-14(19)16-12(13(17)18)7-8-20-2/h3-6,12H,7-9H2,1-2H3,(H,17,18)(H2,15,16,19)/p-1/t12-/m0/s1