2-[5-(hydroxymethyl)-1-(3-methoxypropyl)imidazol-2-yl]sulfanyl-1-(4-methoxyphenyl)ethanone

Systemtic Name: 2-[5-(hydroxymethyl)-1-(3-methoxypropyl)imidazol-2-yl]sulfanyl-1-(4-methoxyphenyl)ethanone Openeye Name: 2-[5-(hydroxymethyl)-1-(3-methoxypropyl)imidazol-2-yl]sulfanyl-1-(4-methoxyphenyl)ethanone CAS Name: 2-[[5-(hydroxymethyl)-1-(3-methoxypropyl)-2-imidazolyl]thio]-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-[5-(hydroxymethyl)-1-(3-methoxypropyl)imidazol-2-yl]sulfanyl-1-(4-methoxyphenyl)ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[[1-(3-methoxypropyl)-5-methylol-imidazol-2-yl]thio]ethanone Formula: C17H22N2O4S MolecularWeight: 350.43258

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=CN=C1SCC(=O)C2=CC=C(C=C2)OC)CO

Isomeric SMILES

COCCCN1C(=CN=C1SCC(=O)C2=CC=C(C=C2)OC)CO

InChI

InChI=1S/C17H22N2O4S/c1-22-9-3-8-19-14(11-20)10-18-17(19)24-12-16(21)13-4-6-15(23-2)7-5-13/h4-7,10,20H,3,8-9,11-12H2,1-2H3