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

Systemtic Name: 6-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-N-[3-(diethylamino)propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: 6-[(2-chloro-6-fluoro-phenyl)methyl]-N-[3-(diethylamino)propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: 6-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(diethylamino)propyl]-5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: 6-[(2-chloro-6-fluorophenyl)methyl]-N-[3-(diethylamino)propyl]-5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 6-(2-chloro-6-fluoro-benzyl)-N-[3-(diethylamino)propyl]-5,7-dimethyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C23H29ClFN5O MolecularWeight: 445.960663

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29ClFN5O/c1-5-29(6-2)12-8-11-26-23(31)19-14-27-30-16(4)17(15(3)28-22(19)30)13-18-20(24)9-7-10-21(18)25/h7,9-10,14H,5-6,8,11-13H2,1-4H3,(H,26,31)