(2R)-2-[(3-methylphenyl)methylcarbamoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2R)-2-[(3-methylphenyl)methylcarbamoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2R)-4-methylsulfanyl-2-(m-tolylmethylcarbamoylamino)butanoic acid CAS Name: (2R)-2-[[[(3-methylphenyl)methylamino]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2R)-2-[(3-methylphenyl)methylcarbamoylamino]-4-methylsulfanylbutanoic acid Traditional Name: (2R)-2-[(3-methylbenzyl)carbamoylamino]-4-(methylthio)butyric acid Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CNC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)CNC(=O)N[C@H](CCSC)C(=O)O

InChI

InChI=1S/C14H20N2O3S/c1-10-4-3-5-11(8-10)9-15-14(19)16-12(13(17)18)6-7-20-2/h3-5,8,12H,6-7,9H2,1-2H3,(H,17,18)(H2,15,16,19)/t12-/m1/s1