methyl 3-[(1-phenylimidazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[(1-phenylimidazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 3-[(1-phenylimidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 3-[[(1-phenyl-2-imidazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(1-phenylimidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[(1-phenylimidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C18H16N2O2S MolecularWeight: 324.39684

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)CSC2=NC=CN2C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)CSC2=NC=CN2C3=CC=CC=C3

InChI

InChI=1S/C18H16N2O2S/c1-22-17(21)15-7-5-6-14(12-15)13-23-18-19-10-11-20(18)16-8-3-2-4-9-16/h2-12H,13H2,1H3