2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-fluoranyl-3-nitro-phenyl)ethanamide Openeye Name: 2-(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitro-phenyl)acetamide CAS Name: 2-[(1-cyclohexyl-4,5-dimethyl-2-imidazolyl)thio]-N-(4-fluoro-3-nitrophenyl)acetamide IUPAC Name: 2-(1-cyclohexyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(4-fluoro-3-nitrophenyl)acetamide Traditional Name: 2-[(1-cyclohexyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(4-fluoro-3-nitro-phenyl)acetamide Formula: C19H23FN4O3S MolecularWeight: 406.474323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C3CCCCC3)C

Isomeric SMILES

CC1=C(N(C(=N1)SCC(=O)NC2=CC(=C(C=C2)F)[N+](=O)[O-])C3CCCCC3)C

InChI

InChI=1S/C19H23FN4O3S/c1-12-13(2)23(15-6-4-3-5-7-15)19(21-12)28-11-18(25)22-14-8-9-16(20)17(10-14)24(26)27/h8-10,15H,3-7,11H2,1-2H3,(H,22,25)