5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-methyl-N-[2-(4-morpholin-4-iumyl)ethyl]-3-phenyl-2-(trifluoromethyl)-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-methyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [5-methyl-3-phenyl-2-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-7-yl]-(2-morpholin-4-ium-4-ylethyl)amine Formula: C20H23F3N5O+ MolecularWeight: 406.42473

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)NCC[NH+]3CCOCC3)C(F)(F)F)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)NCC[NH+]3CCOCC3)C(F)(F)F)C4=CC=CC=C4

InChI

InChI=1S/C20H22F3N5O/c1-14-13-16(24-7-8-27-9-11-29-12-10-27)28-19(25-14)17(15-5-3-2-4-6-15)18(26-28)20(21,22)23/h2-6,13,24H,7-12H2,1H3/p+1