2-[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-propyl-ethanamide

Systemtic Name: 2-[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-propyl-ethanamide Openeye Name: 2-[4-(hydroxymethyl)-1-(p-tolylmethyl)imidazol-2-yl]sulfanyl-N-propyl-acetamide CAS Name: 2-[[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]-2-imidazolyl]thio]-N-propylacetamide IUPAC Name: 2-[4-(hydroxymethyl)-1-[(4-methylphenyl)methyl]imidazol-2-yl]sulfanyl-N-propylacetamide Traditional Name: 2-[[1-(4-methylbenzyl)-4-methylol-imidazol-2-yl]thio]-N-propyl-acetamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CSC1=NC(=CN1CC2=CC=C(C=C2)C)CO

Isomeric SMILES

CCCNC(=O)CSC1=NC(=CN1CC2=CC=C(C=C2)C)CO

InChI

InChI=1S/C17H23N3O2S/c1-3-8-18-16(22)12-23-17-19-15(11-21)10-20(17)9-14-6-4-13(2)5-7-14/h4-7,10,21H,3,8-9,11-12H2,1-2H3,(H,18,22)