methyl 4-[(1-methyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[(1-methyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(1-methyl-5-phenyl-imidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(1-methyl-5-phenyl-2-imidazolyl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(1-methyl-5-phenylimidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(1-methyl-5-phenyl-imidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CN1C(=CN=C1SCC2=CC=C(C=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2S/c1-21-17(15-6-4-3-5-7-15)12-20-19(21)24-13-14-8-10-16(11-9-14)18(22)23-2/h3-12H,13H2,1-2H3