(2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[(3,5-dimethylisoxazole-4-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[(3,5-dimethyl-1,2-oxazole-4-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(3,5-dimethylisoxazole-4-carbonyl)amino]-4-(methylthio)butyrate Formula: C11H15N2O4S- MolecularWeight: 271.3128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=NO1)C)C(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C11H16N2O4S/c1-6-9(7(2)17-13-6)10(14)12-8(11(15)16)4-5-18-3/h8H,4-5H2,1-3H3,(H,12,14)(H,15,16)/p-1/t8-/m0/s1