3-bromanyl-N-(4-cyano-2-methyl-pyrazol-3-yl)benzamide

Systemtic Name: 3-bromanyl-N-(4-cyano-2-methyl-pyrazol-3-yl)benzamide Openeye Name: 3-bromo-N-(4-cyano-2-methyl-pyrazol-3-yl)benzamide CAS Name: 3-bromo-N-(4-cyano-2-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-bromo-N-(4-cyano-2-methylpyrazol-3-yl)benzamide Traditional Name: 3-bromo-N-(4-cyano-2-methyl-pyrazol-3-yl)benzamide Formula: C12H9BrN4O MolecularWeight: 305.13006

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C#N)NC(=O)C2=CC(=CC=C2)Br

Isomeric SMILES

CN1C(=C(C=N1)C#N)NC(=O)C2=CC(=CC=C2)Br

InChI

InChI=1S/C12H9BrN4O/c1-17-11(9(6-14)7-15-17)16-12(18)8-3-2-4-10(13)5-8/h2-5,7H,1H3,(H,16,18)