N-(8-bromanyl-2-butyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloranyl-benzamide

Systemtic Name: N-(8-bromanyl-2-butyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloranyl-benzamide Openeye Name: N-(8-bromo-2-butyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloro-benzamide CAS Name: N-(8-bromo-2-butyl-4-pyrazolo[1,5-a][1,3,5]triazinyl)-3-chlorobenzamide IUPAC Name: N-(8-bromo-2-butylpyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chlorobenzamide Traditional Name: N-(8-bromo-2-butyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloro-benzamide Formula: C16H15BrClN5O MolecularWeight: 408.6802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C=NN2C(=N1)NC(=O)C3=CC(=CC=C3)Cl)Br

Isomeric SMILES

CCCCC1=NC2=C(C=NN2C(=N1)NC(=O)C3=CC(=CC=C3)Cl)Br

InChI

InChI=1S/C16H15BrClN5O/c1-2-3-7-13-20-14-12(17)9-19-23(14)16(21-13)22-15(24)10-5-4-6-11(18)8-10/h4-6,8-9H,2-3,7H2,1H3,(H,20,21,22,24)