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

Systemtic Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-fluoranyl-5-nitro-phenyl)ethanamide Openeye Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-fluoro-5-nitro-phenyl)acetamide CAS Name: 2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-N-(2-fluoro-5-nitrophenyl)acetamide IUPAC Name: 2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(2-fluoro-5-nitrophenyl)acetamide Traditional Name: 2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-fluoro-5-nitro-phenyl)acetamide Formula: C18H21FN4O3S MolecularWeight: 392.447743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21FN4O3S/c1-11-12(2)22(13-5-3-4-6-13)18(20-11)27-10-17(24)21-16-9-14(23(25)26)7-8-15(16)19/h7-9,13H,3-6,10H2,1-2H3,(H,21,24)