N-(2-chloranyl-4-nitro-phenyl)-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide

Systemtic Name: N-(2-chloranyl-4-nitro-phenyl)-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide Openeye Name: N-(2-chloro-4-nitro-phenyl)-2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-propanamide CAS Name: N-(2-chloro-4-nitrophenyl)-2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]propanamide IUPAC Name: N-(2-chloro-4-nitrophenyl)-2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanylpropanamide Traditional Name: N-(2-chloro-4-nitro-phenyl)-2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]propionamide Formula: C20H25ClN4O3S MolecularWeight: 436.9555

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SC(C)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl)C3CCCCC3)C

InChI

InChI=1S/C20H25ClN4O3S/c1-12-13(2)24(15-7-5-4-6-8-15)20(22-12)29-14(3)19(26)23-18-10-9-16(25(27)28)11-17(18)21/h9-11,14-15H,4-8H2,1-3H3,(H,23,26)