1-[[1-methyl-3-(phenylmethyl)-2H-imidazol-2-yl]sulfanyl]-3-phenoxy-propan-2-one chloride

Systemtic Name: 1-[[1-methyl-3-(phenylmethyl)-2H-imidazol-2-yl]sulfanyl]-3-phenoxy-propan-2-one chloride Openeye Name: 1-[(1-benzyl-3-methyl-2H-imidazol-2-yl)sulfanyl]-3-phenoxy-propan-2-one chloride CAS Name: 1-[[1-methyl-3-(phenylmethyl)-2H-imidazol-2-yl]thio]-3-phenoxy-2-propanone chloride IUPAC Name: 1-[(1-benzyl-3-methyl-2H-imidazol-2-yl)sulfanyl]-3-phenoxypropan-2-one chloride Traditional Name: 1-[(1-benzyl-3-methyl-4-imidazolin-2-yl)thio]-3-phenoxy-acetone chloride Formula: C20H22ClN2O2S- MolecularWeight: 389.91888

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN(C1SCC(=O)COC2=CC=CC=C2)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CN1C=CN(C1SCC(=O)COC2=CC=CC=C2)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H22N2O2S.ClH/c1-21-12-13-22(14-17-8-4-2-5-9-17)20(21)25-16-18(23)15-24-19-10-6-3-7-11-19;/h2-13,20H,14-16H2,1H3;1H/p-1