2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloranylpyridin-2-yl)ethanamide

Systemtic Name: 2-(5-bromanyl-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloranylpyridin-2-yl)ethanamide Openeye Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloro-2-pyridyl)acetamide CAS Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloro-2-pyridinyl)acetamide IUPAC Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloropyridin-2-yl)acetamide Traditional Name: 2-(5-bromo-3-nitro-1,2,4-triazol-1-yl)-N-(5-chloro-2-pyridyl)acetamide Formula: C9H6BrClN6O3 MolecularWeight: 361.53934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1Cl)NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=NC=C1Cl)NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])Br

InChI

InChI=1S/C9H6BrClN6O3/c10-8-14-9(17(19)20)15-16(8)4-7(18)13-6-2-1-5(11)3-12-6/h1-3H,4H2,(H,12,13,18)