azepan-1-yl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone

Systemtic Name: azepan-1-yl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone Openeye Name: azepan-1-yl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone CAS Name: 1-azepanyl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)-3-pyrazolo[1,5-a]pyrimidinyl]methanone IUPAC Name: azepan-1-yl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone Traditional Name: azepan-1-yl-[7-(trifluoromethyl)-5-(3,4,5-trimethoxyphenyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone Formula: C23H25F3N4O4 MolecularWeight: 478.46421

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=NC3=C(C=NN3C(=C2)C(F)(F)F)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H25F3N4O4/c1-32-17-10-14(11-18(33-2)20(17)34-3)16-12-19(23(24,25)26)30-21(28-16)15(13-27-30)22(31)29-8-6-4-5-7-9-29/h10-13H,4-9H2,1-3H3