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

Systemtic Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-nitrophenyl)ethanamide Openeye Name: 2-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-nitrophenyl)acetamide CAS Name: 2-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-nitrophenyl)acetamide Formula: C17H22N4O3S MolecularWeight: 362.44658

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N4O3S/c1-11(2)9-20-13(4)12(3)18-17(20)25-10-16(22)19-14-7-5-6-8-15(14)21(23)24/h5-8,11H,9-10H2,1-4H3,(H,19,22)