N-(2-cyano-4-nitro-phenyl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyano-4-nitro-phenyl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyano-4-nitro-phenyl)-2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyano-4-nitrophenyl)-2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]acetamide IUPAC Name: N-(2-cyano-4-nitrophenyl)-2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanylacetamide Traditional Name: N-(2-cyano-4-nitro-phenyl)-2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]acetamide Formula: C19H21N5O3S MolecularWeight: 399.46674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3CCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])C#N)C3CCCC3)C

InChI

InChI=1S/C19H21N5O3S/c1-12-13(2)23(15-5-3-4-6-15)19(21-12)28-11-18(25)22-17-8-7-16(24(26)27)9-14(17)10-20/h7-9,15H,3-6,11H2,1-2H3,(H,22,25)