N-tert-butyl-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-tert-butyl-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-tert-butyl-acetamide CAS Name: N-tert-butyl-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-tert-butylacetamide Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-N-tert-butyl-acetamide Formula: C17H23N3O2S MolecularWeight: 333.44842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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