methyl 2-(1-phenylimidazol-2-yl)sulfanylpropanoate

Systemtic Name: methyl 2-(1-phenylimidazol-2-yl)sulfanylpropanoate Openeye Name: methyl 2-(1-phenylimidazol-2-yl)sulfanylpropanoate CAS Name: 2-[(1-phenyl-2-imidazolyl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-(1-phenylimidazol-2-yl)sulfanylpropanoate Traditional Name: 2-[(1-phenylimidazol-2-yl)thio]propionic acid methyl ester Formula: C13H14N2O2S MolecularWeight: 262.32746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)SC1=NC=CN1C2=CC=CC=C2

Isomeric SMILES

CC(C(=O)OC)SC1=NC=CN1C2=CC=CC=C2

InChI

InChI=1S/C13H14N2O2S/c1-10(12(16)17-2)18-13-14-8-9-15(13)11-6-4-3-5-7-11/h3-10H,1-2H3