(2R)-2-[(2-ethylsulfanylpyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[(2-ethylsulfanylpyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[(2-ethylsulfanylpyridine-3-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[[2-(ethylthio)-3-pyridinyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[(2-ethylsulfanylpyridine-3-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[[2-(ethylthio)nicotinoyl]amino]-4-(methylthio)butyrate Formula: C13H17N2O3S2- MolecularWeight: 313.41568

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C(C=CC=N1)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CCSC1=C(C=CC=N1)C(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C13H18N2O3S2/c1-3-20-12-9(5-4-7-14-12)11(16)15-10(13(17)18)6-8-19-2/h4-5,7,10H,3,6,8H2,1-2H3,(H,15,16)(H,17,18)/p-1/t10-/m1/s1