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

Systemtic Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide Openeye Name: 2-(1-isobutyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(2-nitrophenyl)propanamide CAS Name: 2-[[4,5-dimethyl-1-(2-methylpropyl)-2-imidazolyl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 2-[4,5-dimethyl-1-(2-methylpropyl)imidazol-2-yl]sulfanyl-N-(2-nitrophenyl)propanamide Traditional Name: 2-[(1-isobutyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(2-nitrophenyl)propionamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N4O3S/c1-11(2)10-21-13(4)12(3)19-18(21)26-14(5)17(23)20-15-8-6-7-9-16(15)22(24)25/h6-9,11,14H,10H2,1-5H3,(H,20,23)