O-methyl 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioate

Systemtic Name: O-methyl 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioate Openeye Name: O-methyl 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioate CAS Name: 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioic acid O-methyl ester IUPAC Name: O-methyl 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioate Traditional Name: 2-(1H-imidazol-5-ylmethyl)-3-(4-methoxyphenyl)propanethioic acid O-methyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(CC2=CN=CN2)C(=S)OC

Isomeric SMILES

COC1=CC=C(C=C1)CC(CC2=CN=CN2)C(=S)OC

InChI

InChI=1S/C15H18N2O2S/c1-18-14-5-3-11(4-6-14)7-12(15(20)19-2)8-13-9-16-10-17-13/h3-6,9-10,12H,7-8H2,1-2H3,(H,16,17)