N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-cyano-benzamide

Systemtic Name: N-[3-(4-bromanylpyrazol-1-yl)propyl]-3-cyano-benzamide Openeye Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-cyano-benzamide CAS Name: N-[3-(4-bromo-1-pyrazolyl)propyl]-3-cyanobenzamide IUPAC Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-cyanobenzamide Traditional Name: N-[3-(4-bromopyrazol-1-yl)propyl]-3-cyano-benzamide Formula: C14H13BrN4O MolecularWeight: 333.18322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NCCCN2C=C(C=N2)Br)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NCCCN2C=C(C=N2)Br)C#N

InChI

InChI=1S/C14H13BrN4O/c15-13-9-18-19(10-13)6-2-5-17-14(20)12-4-1-3-11(7-12)8-16/h1,3-4,7,9-10H,2,5-6H2,(H,17,20)