2,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine

Systemtic Name: 2,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-6-(phenylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 6-benzyl-2,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 2,5-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-3-phenyl-6-(phenylmethyl)-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 6-benzyl-2,5-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-3-phenylpyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: (6-benzyl-2,5-dimethyl-3-phenyl-pyrazolo[1,5-a]pyrimidin-7-yl)-(2-morpholin-4-ium-4-ylethyl)amine Formula: C27H32N5O+ MolecularWeight: 442.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1CC3=CC=CC=C3)NCC[NH+]4CCOCC4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1CC3=CC=CC=C3)NCC[NH+]4CCOCC4)C)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O/c1-20-24(19-22-9-5-3-6-10-22)26(28-13-14-31-15-17-33-18-16-31)32-27(29-20)25(21(2)30-32)23-11-7-4-8-12-23/h3-12,28H,13-19H2,1-2H3/p+1