3-bromanyl-N-(4-cyano-2,5-dimethyl-pyrazol-3-yl)benzamide

Systemtic Name: 3-bromanyl-N-(4-cyano-2,5-dimethyl-pyrazol-3-yl)benzamide Openeye Name: 3-bromo-N-(4-cyano-2,5-dimethyl-pyrazol-3-yl)benzamide CAS Name: 3-bromo-N-(4-cyano-2,5-dimethyl-3-pyrazolyl)benzamide IUPAC Name: 3-bromo-N-(4-cyano-2,5-dimethylpyrazol-3-yl)benzamide Traditional Name: 3-bromo-N-(4-cyano-2,5-dimethyl-pyrazol-3-yl)benzamide Formula: C13H11BrN4O MolecularWeight: 319.15664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)NC(=O)C2=CC(=CC=C2)Br)C

Isomeric SMILES

CC1=NN(C(=C1C#N)NC(=O)C2=CC(=CC=C2)Br)C

InChI

InChI=1S/C13H11BrN4O/c1-8-11(7-15)12(18(2)17-8)16-13(19)9-4-3-5-10(14)6-9/h3-6H,1-2H3,(H,16,19)