2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-methyl-2-nitro-phenyl)ethanamide

Systemtic Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-methyl-2-nitro-phenyl)ethanamide Openeye Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-methyl-2-nitro-phenyl)acetamide CAS Name: 2-[[1-(3,4-dimethylphenyl)-2-imidazolyl]thio]-N-(4-methyl-2-nitrophenyl)acetamide IUPAC Name: 2-[1-(3,4-dimethylphenyl)imidazol-2-yl]sulfanyl-N-(4-methyl-2-nitrophenyl)acetamide Traditional Name: 2-[[1-(3,4-dimethylphenyl)imidazol-2-yl]thio]-N-(4-methyl-2-nitro-phenyl)acetamide Formula: C20H20N4O3S MolecularWeight: 396.4628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=C(C=C3)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CN2C3=CC(=C(C=C3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O3S/c1-13-4-7-17(18(10-13)24(26)27)22-19(25)12-28-20-21-8-9-23(20)16-6-5-14(2)15(3)11-16/h4-11H,12H2,1-3H3,(H,22,25)