2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[(1-cyclopentyl-4,5-dimethyl-2-imidazolyl)thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-(1-cyclopentyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(1-cyclopentyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N4O3S/c1-12-13(2)21(14-7-3-4-8-14)18(19-12)26-11-17(23)20-15-9-5-6-10-16(15)22(24)25/h5-6,9-10,14H,3-4,7-8,11H2,1-2H3,(H,20,23)