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

Systemtic Name: 2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 2-methyl-N-[3-(4-morpholin-4-iumyl)propyl]-3,5-diphenyl-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 2-methyl-N-(3-morpholin-4-ium-4-ylpropyl)-3,5-diphenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (2-methyl-3,5-diphenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C26H30N5O+ MolecularWeight: 428.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=CC=C4)NCCC[NH+]5CCOCC5

Isomeric SMILES

CC1=NN2C(=CC(=NC2=C1C3=CC=CC=C3)C4=CC=CC=C4)NCCC[NH+]5CCOCC5

InChI

InChI=1S/C26H29N5O/c1-20-25(22-11-6-3-7-12-22)26-28-23(21-9-4-2-5-10-21)19-24(31(26)29-20)27-13-8-14-30-15-17-32-18-16-30/h2-7,9-12,19,27H,8,13-18H2,1H3/p+1