N-(4,5-dimethyl-2-nitro-phenyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanamide Openeye Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanyl-acetamide CAS Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[[1-(2,4-dimethylphenyl)-2-imidazolyl]thio]acetamide IUPAC Name: N-(4,5-dimethyl-2-nitrophenyl)-2-[1-(2,4-dimethylphenyl)imidazol-2-yl]sulfanylacetamide Traditional Name: N-(4,5-dimethyl-2-nitro-phenyl)-2-[[1-(2,4-dimethylphenyl)imidazol-2-yl]thio]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)NC3=C(C=C(C(=C3)C)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=CN=C2SCC(=O)NC3=C(C=C(C(=C3)C)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H22N4O3S/c1-13-5-6-18(16(4)9-13)24-8-7-22-21(24)29-12-20(26)23-17-10-14(2)15(3)11-19(17)25(27)28/h5-11H,12H2,1-4H3,(H,23,26)