7-[bis(fluoranyl)methyl]-N-cycloheptyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: 7-[bis(fluoranyl)methyl]-N-cycloheptyl-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-cycloheptyl-7-(difluoromethyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-cycloheptyl-7-(difluoromethyl)-5-phenyl-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-cycloheptyl-7-(difluoromethyl)-5-phenylpyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-cycloheptyl-7-(difluoromethyl)-5-phenyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C21H22F2N4O MolecularWeight: 384.422386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=C3N=C(C=C(N3N=C2)C(F)F)C4=CC=CC=C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=C3N=C(C=C(N3N=C2)C(F)F)C4=CC=CC=C4

InChI

InChI=1S/C21H22F2N4O/c22-19(23)18-12-17(14-8-4-3-5-9-14)26-20-16(13-24-27(18)20)21(28)25-15-10-6-1-2-7-11-15/h3-5,8-9,12-13,15,19H,1-2,6-7,10-11H2,(H,25,28)