ethyl 2-azido-3-[3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-imidazol-4-yl]-3-oxidanyl-propanoate

Systemtic Name: ethyl 2-azido-3-[3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-imidazol-4-yl]-3-oxidanyl-propanoate Openeye Name: ethyl 2-azido-3-hydroxy-3-[3-[(4-methoxyphenyl)methyl]-2-methylsulfanyl-imidazol-4-yl]propanoate CAS Name: 2-azido-3-hydroxy-3-[3-[(4-methoxyphenyl)methyl]-2-(methylthio)-4-imidazolyl]propanoic acid ethyl ester IUPAC Name: ethyl 2-azido-3-hydroxy-3-[3-[(4-methoxyphenyl)methyl]-2-methylsulfanylimidazol-4-yl]propanoate Traditional Name: 2-azido-3-hydroxy-3-[2-(methylthio)-3-p-anisyl-imidazol-4-yl]propionic acid ethyl ester Formula: C17H21N5O4S MolecularWeight: 391.44474

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CN=C(N1CC2=CC=C(C=C2)OC)SC)O)N=[N+]=[N-]

Isomeric SMILES

CCOC(=O)C(C(C1=CN=C(N1CC2=CC=C(C=C2)OC)SC)O)N=[N+]=[N-]

InChI

InChI=1S/C17H21N5O4S/c1-4-26-16(24)14(20-21-18)15(23)13-9-19-17(27-3)22(13)10-11-5-7-12(25-2)8-6-11/h5-9,14-15,23H,4,10H2,1-3H3