methyl (2S)-2-[(1-cyclohexyl-1,2,3-triazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: methyl (2S)-2-[(1-cyclohexyl-1,2,3-triazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: methyl (2S)-2-[(1-cyclohexyltriazole-4-carbonyl)amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[(1-cyclohexyl-4-triazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1-cyclohexyltriazole-4-carbonyl)amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[(1-cyclohexyltriazole-4-carbonyl)amino]-4-(methylthio)butyric acid methyl ester Formula: C15H24N4O3S MolecularWeight: 340.44106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCSC)NC(=O)C1=CN(N=N1)C2CCCCC2

Isomeric SMILES

COC(=O)[C@H](CCSC)NC(=O)C1=CN(N=N1)C2CCCCC2

InChI

InChI=1S/C15H24N4O3S/c1-22-15(21)12(8-9-23-2)16-14(20)13-10-19(18-17-13)11-6-4-3-5-7-11/h10-12H,3-9H2,1-2H3,(H,16,20)/t12-/m0/s1