6-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-hexyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 6-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-hexyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 6-[(2-chloro-6-fluoro-phenyl)methyl]-N-hexyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 6-[(2-chloro-6-fluorophenyl)methyl]-N-hexyl-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 6-[(2-chloro-6-fluorophenyl)methyl]-N-hexyl-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 6-(2-chloro-6-fluoro-benzyl)-N-hexyl-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C22H26ClFN4O MolecularWeight: 416.919443

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=C2N=C(C(=C(N2N=C1)C)CC3=C(C=CC=C3Cl)F)C

Isomeric SMILES

CCCCCCNC(=O)C1=C2N=C(C(=C(N2N=C1)C)CC3=C(C=CC=C3Cl)F)C

InChI

InChI=1S/C22H26ClFN4O/c1-4-5-6-7-11-25-22(29)18-13-26-28-15(3)16(14(2)27-21(18)28)12-17-19(23)9-8-10-20(17)24/h8-10,13H,4-7,11-12H2,1-3H3,(H,25,29)