N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide

Systemtic Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-2-[(4-nitrophenyl)methylsulfanyl]ethanamide Openeye Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide CAS Name: N-[[2-(2-methyl-1-imidazolyl)phenyl]methyl]-2-[(4-nitrophenyl)methylthio]acetamide IUPAC Name: N-[[2-(2-methylimidazol-1-yl)phenyl]methyl]-2-[(4-nitrophenyl)methylsulfanyl]acetamide Traditional Name: N-[2-(2-methylimidazol-1-yl)benzyl]-2-[(4-nitrobenzyl)thio]acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CN1C2=CC=CC=C2CNC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=CN1C2=CC=CC=C2CNC(=O)CSCC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-15-21-10-11-23(15)19-5-3-2-4-17(19)12-22-20(25)14-28-13-16-6-8-18(9-7-16)24(26)27/h2-11H,12-14H2,1H3,(H,22,25)