2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)ethanamide

Systemtic Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitro-phenyl)ethanamide Openeye Name: 2-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-methoxy-4-nitro-phenyl)acetamide CAS Name: 2-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]-N-(2-methoxy-4-nitrophenyl)acetamide IUPAC Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-methoxy-4-nitrophenyl)acetamide Traditional Name: 2-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-methoxy-4-nitro-phenyl)acetamide Formula: C18H24N4O4S MolecularWeight: 392.47256

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O4S/c1-11(2)9-21-13(4)12(3)19-18(21)27-10-17(23)20-15-7-6-14(22(24)25)8-16(15)26-5/h6-8,11H,9-10H2,1-5H3,(H,20,23)