2-[2-[(4-bromophenyl)methylsulfanyl]-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropyl-ethanamide

Systemtic Name: 2-[2-[(4-bromophenyl)methylsulfanyl]-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropyl-ethanamide Openeye Name: 2-[2-[(4-bromophenyl)methylsulfanyl]-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropyl-acetamide CAS Name: 2-[2-[(4-bromophenyl)methylthio]-5-(hydroxymethyl)-1-imidazolyl]-N-cyclopropylacetamide IUPAC Name: 2-[2-[(4-bromophenyl)methylsulfanyl]-5-(hydroxymethyl)imidazol-1-yl]-N-cyclopropylacetamide Traditional Name: 2-[2-[(4-bromobenzyl)thio]-5-methylol-imidazol-1-yl]-N-cyclopropyl-acetamide Formula: C16H18BrN3O2S MolecularWeight: 396.30202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)CN2C(=CN=C2SCC3=CC=C(C=C3)Br)CO

Isomeric SMILES

C1CC1NC(=O)CN2C(=CN=C2SCC3=CC=C(C=C3)Br)CO

InChI

InChI=1S/C16H18BrN3O2S/c17-12-3-1-11(2-4-12)10-23-16-18-7-14(9-21)20(16)8-15(22)19-13-5-6-13/h1-4,7,13,21H,5-6,8-10H2,(H,19,22)