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

Systemtic Name: ethyl 2-azido-3-[2-ethylsulfanyl-3-[(4-methoxyphenyl)methyl]imidazol-4-yl]-3-oxidanyl-propanoate Openeye Name: ethyl 2-azido-3-[2-ethylsulfanyl-3-[(4-methoxyphenyl)methyl]imidazol-4-yl]-3-hydroxy-propanoate CAS Name: 2-azido-3-[2-(ethylthio)-3-[(4-methoxyphenyl)methyl]-4-imidazolyl]-3-hydroxypropanoic acid ethyl ester IUPAC Name: ethyl 2-azido-3-[2-ethylsulfanyl-3-[(4-methoxyphenyl)methyl]imidazol-4-yl]-3-hydroxypropanoate Traditional Name: 2-azido-3-[2-(ethylthio)-3-p-anisyl-imidazol-4-yl]-3-hydroxy-propionic acid ethyl ester Formula: C18H23N5O4S MolecularWeight: 405.47132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O4S/c1-4-27-17(25)15(21-22-19)16(24)14-10-20-18(28-5-2)23(14)11-12-6-8-13(26-3)9-7-12/h6-10,15-16,24H,4-5,11H2,1-3H3