N-(2-butyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloranyl-benzamide

Systemtic Name: N-(2-butyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloranyl-benzamide Openeye Name: N-(2-butyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloro-benzamide CAS Name: N-(2-butyl-7-phenyl-4-pyrazolo[1,5-a][1,3,5]triazinyl)-3-chlorobenzamide IUPAC Name: N-(2-butyl-7-phenylpyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chlorobenzamide Traditional Name: N-(2-butyl-7-phenyl-pyrazolo[1,5-a][1,3,5]triazin-4-yl)-3-chloro-benzamide Formula: C22H20ClN5O MolecularWeight: 405.8801

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=CC(=NN2C(=N1)NC(=O)C3=CC(=CC=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC2=CC(=NN2C(=N1)NC(=O)C3=CC(=CC=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H20ClN5O/c1-2-3-12-19-24-20-14-18(15-8-5-4-6-9-15)27-28(20)22(25-19)26-21(29)16-10-7-11-17(23)13-16/h4-11,13-14H,2-3,12H2,1H3,(H,24,25,26,29)