2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]-N-methyl-ethanamide

Systemtic Name: 2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]-N-methyl-ethanamide Openeye Name: 2-[5-(hydroxymethyl)-2-phenethylsulfanyl-imidazol-1-yl]-N-methyl-acetamide CAS Name: 2-[5-(hydroxymethyl)-2-(phenethylthio)-1-imidazolyl]-N-methylacetamide IUPAC Name: 2-[5-(hydroxymethyl)-2-phenethylsulfanylimidazol-1-yl]-N-methylacetamide Traditional Name: N-methyl-2-[5-methylol-2-(phenethylthio)imidazol-1-yl]acetamide Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN1C(=CN=C1SCCC2=CC=CC=C2)CO

Isomeric SMILES

CNC(=O)CN1C(=CN=C1SCCC2=CC=CC=C2)CO

InChI

InChI=1S/C15H19N3O2S/c1-16-14(20)10-18-13(11-19)9-17-15(18)21-8-7-12-5-3-2-4-6-12/h2-6,9,19H,7-8,10-11H2,1H3,(H,16,20)