N-(5-bromanylpyridin-2-yl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide Openeye Name: N-(5-bromo-2-pyridyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propanamide CAS Name: N-(5-bromo-2-pyridinyl)-3-(3,5-dimethyl-4-nitro-1-pyrazolyl)propanamide IUPAC Name: N-(5-bromopyridin-2-yl)-3-(3,5-dimethyl-4-nitropyrazol-1-yl)propanamide Traditional Name: N-(5-bromo-2-pyridyl)-3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)propionamide Formula: C13H14BrN5O3 MolecularWeight: 368.18596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC(=O)NC2=NC=C(C=C2)Br)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CCC(=O)NC2=NC=C(C=C2)Br)C)[N+](=O)[O-]

InChI

InChI=1S/C13H14BrN5O3/c1-8-13(19(21)22)9(2)18(17-8)6-5-12(20)16-11-4-3-10(14)7-15-11/h3-4,7H,5-6H2,1-2H3,(H,15,16,20)