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

Systemtic Name: methyl 4-[(5-phenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoate Openeye Name: methyl 4-[(5-phenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 4-[[(5-phenyl-1H-imidazol-2-yl)thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-phenyl-1H-imidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 4-[[(5-phenyl-1H-imidazol-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=C(C=C1)CSC2=NC=C(N2)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NC=C(N2)C3=CC=CC=C3

InChI

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