ethyl 2-[[2-(1-azanylethyl)-1,3-oxazol-4-yl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: ethyl 2-[[2-(1-azanylethyl)-1,3-oxazol-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-(1-aminoethyl)-4-oxazolyl]-oxomethyl]amino]-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-aminoethyl)-1,3-oxazole-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(1-aminoethyl)oxazole-4-carbonyl]amino]-4-(methylthio)butyric acid ethyl ester Formula: C13H21N3O4S MolecularWeight: 315.38854

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)C1=COC(=N1)C(C)N

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)C1=COC(=N1)C(C)N

InChI

InChI=1S/C13H21N3O4S/c1-4-19-13(18)9(5-6-21-3)15-11(17)10-7-20-12(16-10)8(2)14/h7-9H,4-6,14H2,1-3H3,(H,15,17)