methyl 3-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 3-[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]sulfanylmethyl]benzoate Openeye Name: methyl 3-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]benzoate CAS Name: 3-[[[5-methyl-4-(phenylmethyl)-1H-imidazol-2-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-benzyl-5-methyl-1H-imidazol-2-yl)sulfanylmethyl]benzoate Traditional Name: 3-[[(4-benzyl-5-methyl-1H-imidazol-2-yl)thio]methyl]benzoic acid methyl ester Formula: C20H20N2O2S MolecularWeight: 352.45

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N1)SCC2=CC=CC(=C2)C(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(N=C(N1)SCC2=CC=CC(=C2)C(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2S/c1-14-18(12-15-7-4-3-5-8-15)22-20(21-14)25-13-16-9-6-10-17(11-16)19(23)24-2/h3-11H,12-13H2,1-2H3,(H,21,22)