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

Systemtic Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-3-phenyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C20H26N5O+ MolecularWeight: 352.45334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N5O/c1-16-14-19(21-8-5-9-24-10-12-26-13-11-24)25-20(23-16)18(15-22-25)17-6-3-2-4-7-17/h2-4,6-7,14-15,21H,5,8-13H2,1H3/p+1