ethyl 3-(2-methylsulfanylimidazol-1-yl)benzoate

Systemtic Name: ethyl 3-(2-methylsulfanylimidazol-1-yl)benzoate Openeye Name: ethyl 3-(2-methylsulfanylimidazol-1-yl)benzoate CAS Name: 3-[2-(methylthio)-1-imidazolyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-methylsulfanylimidazol-1-yl)benzoate Traditional Name: 3-[2-(methylthio)imidazol-1-yl]benzoic acid ethyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N2C=CN=C2SC

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N2C=CN=C2SC

InChI

InChI=1S/C13H14N2O2S/c1-3-17-12(16)10-5-4-6-11(9-10)15-8-7-14-13(15)18-2/h4-9H,3H2,1-2H3