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

Systemtic Name: N-(4-ethylphenyl)-2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(4-ethylphenyl)acetamide CAS Name: N-(4-ethylphenyl)-2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]acetamide IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-N-(4-ethylphenyl)acetamide Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-N-(4-ethylphenyl)acetamide Formula: C21H23N3O2S MolecularWeight: 381.49122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

InChI

InChI=1S/C21H23N3O2S/c1-2-16-8-10-18(11-9-16)22-20(26)15-27-21-23-19(14-25)13-24(21)12-17-6-4-3-5-7-17/h3-11,13,25H,2,12,14-15H2,1H3,(H,22,26)