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

Systemtic Name: 3-(2-methoxyphenyl)-2,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine Openeye Name: 3-(2-methoxyphenyl)-2,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine CAS Name: 3-(2-methoxyphenyl)-2,5-dimethyl-N-[3-(4-morpholin-4-iumyl)propyl]-7-pyrazolo[1,5-a]pyrimidinamine IUPAC Name: 3-(2-methoxyphenyl)-2,5-dimethyl-N-(3-morpholin-4-ium-4-ylpropyl)pyrazolo[1,5-a]pyrimidin-7-amine Traditional Name: [3-(2-methoxyphenyl)-2,5-dimethyl-pyrazolo[1,5-a]pyrimidin-7-yl]-(3-morpholin-4-ium-4-ylpropyl)amine Formula: C22H30N5O2+ MolecularWeight: 396.5059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C(=C1)NCCC[NH+]3CCOCC3)C)C4=CC=CC=C4OC

Isomeric SMILES

CC1=NC2=C(C(=NN2C(=C1)NCCC[NH+]3CCOCC3)C)C4=CC=CC=C4OC

InChI

InChI=1S/C22H29N5O2/c1-16-15-20(23-9-6-10-26-11-13-29-14-12-26)27-22(24-16)21(17(2)25-27)18-7-4-5-8-19(18)28-3/h4-5,7-8,15,23H,6,9-14H2,1-3H3/p+1