2-[5-(hydroxymethyl)-2-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-imidazol-1-yl]-N-methyl-ethanamide

Systemtic Name: 2-[5-(hydroxymethyl)-2-[2-[(4-methylphenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-imidazol-1-yl]-N-methyl-ethanamide Openeye Name: 2-[5-(hydroxymethyl)-2-[2-oxo-2-(p-tolylmethylamino)ethyl]sulfanyl-imidazol-1-yl]-N-methyl-acetamide CAS Name: 2-[5-(hydroxymethyl)-2-[[2-[(4-methylphenyl)methylamino]-2-oxoethyl]thio]-1-imidazolyl]-N-methylacetamide IUPAC Name: 2-[5-(hydroxymethyl)-2-[2-[(4-methylphenyl)methylamino]-2-oxoethyl]sulfanylimidazol-1-yl]-N-methylacetamide Traditional Name: 2-[2-[[2-keto-2-[(4-methylbenzyl)amino]ethyl]thio]-5-methylol-imidazol-1-yl]-N-methyl-acetamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)CSC2=NC=C(N2CC(=O)NC)CO

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)CSC2=NC=C(N2CC(=O)NC)CO

InChI

InChI=1S/C17H22N4O3S/c1-12-3-5-13(6-4-12)7-19-16(24)11-25-17-20-8-14(10-22)21(17)9-15(23)18-2/h3-6,8,22H,7,9-11H2,1-2H3,(H,18,23)(H,19,24)