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

Systemtic Name: ethyl 2-[[2-(1-azanyl-2-phenyl-ethyl)-1,3-oxazol-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-[[2-(1-amino-2-phenyl-ethyl)oxazole-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-(1-amino-2-phenylethyl)-4-oxazolyl]-oxomethyl]amino]-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1-amino-2-phenylethyl)-1,3-oxazole-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-(1-amino-2-phenyl-ethyl)oxazole-4-carbonyl]amino]-4-(methylthio)butyric acid ethyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC)NC(=O)C1=COC(=N1)C(CC2=CC=CC=C2)N

Isomeric SMILES

CCOC(=O)C(CCSC)NC(=O)C1=COC(=N1)C(CC2=CC=CC=C2)N

InChI

InChI=1S/C19H25N3O4S/c1-3-25-19(24)15(9-10-27-2)21-17(23)16-12-26-18(22-16)14(20)11-13-7-5-4-6-8-13/h4-8,12,14-15H,3,9-11,20H2,1-2H3,(H,21,23)