methyl (2S)-2-[(6-chloranylpyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[(6-chloranylpyridin-3-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[(6-chloropyridine-3-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(6-chloro-3-pyridinyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(6-chloropyridine-3-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(6-chloronicotinoyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C12H15ClN2O3S MolecularWeight: 302.7771

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CN=C(C=C1)Cl

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)C1=CN=C(C=C1)Cl

InChI

InChI=1S/C12H15ClN2O3S/c1-18-12(17)9(5-6-19-2)15-11(16)8-3-4-10(13)14-7-8/h3-4,7,9H,5-6H2,1-2H3,(H,15,16)/t9-/m0/s1