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

Systemtic Name: 2-ethyl-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 2-ethyl-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 2-ethyl-5-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-3-phenyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 2-ethyl-5-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (2-ethyl-5-methyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C22H30N5O+ MolecularWeight: 380.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C)NCCC[NH+]4CCOCC4

Isomeric SMILES

CCC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C)NCCC[NH+]4CCOCC4

InChI

InChI=1S/C22H29N5O/c1-3-19-21(18-8-5-4-6-9-18)22-24-17(2)16-20(27(22)25-19)23-10-7-11-26-12-14-28-15-13-26/h4-6,8-9,16,23H,3,7,10-15H2,1-2H3/p+1