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

Systemtic Name: ethyl 2-[[2-[1-azanyl-2-(4-hydroxyphenyl)ethyl]-1,3-oxazol-4-yl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: ethyl 2-[[2-[1-amino-2-(4-hydroxyphenyl)ethyl]oxazole-4-carbonyl]amino]-4-methylsulfanyl-butanoate CAS Name: 2-[[[2-[1-amino-2-(4-hydroxyphenyl)ethyl]-4-oxazolyl]-oxomethyl]amino]-4-(methylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[1-amino-2-(4-hydroxyphenyl)ethyl]-1,3-oxazole-4-carbonyl]amino]-4-methylsulfanylbutanoate Traditional Name: 2-[[2-[1-amino-2-(4-hydroxyphenyl)ethyl]oxazole-4-carbonyl]amino]-4-(methylthio)butyric acid ethyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O5S/c1-3-26-19(25)15(8-9-28-2)21-17(24)16-11-27-18(22-16)14(20)10-12-4-6-13(23)7-5-12/h4-7,11,14-15,23H,3,8-10,20H2,1-2H3,(H,21,24)