4-[1-(2-methoxyphenyl)pyrazol-4-yl]-N-[[(3R)-1-methylpyrrolidin-1-ium-3-yl]methyl]pyrimidin-2-amine

Systemtic Name: 4-[1-(2-methoxyphenyl)pyrazol-4-yl]-N-[[(3R)-1-methylpyrrolidin-1-ium-3-yl]methyl]pyrimidin-2-amine Openeye Name: 4-[1-(2-methoxyphenyl)pyrazol-4-yl]-N-[[(3R)-1-methylpyrrolidin-1-ium-3-yl]methyl]pyrimidin-2-amine CAS Name: 4-[1-(2-methoxyphenyl)-4-pyrazolyl]-N-[[(3R)-1-methyl-3-pyrrolidin-1-iumyl]methyl]-2-pyrimidinamine IUPAC Name: 4-[1-(2-methoxyphenyl)pyrazol-4-yl]-N-[[(3R)-1-methylpyrrolidin-1-ium-3-yl]methyl]pyrimidin-2-amine Traditional Name: [4-[1-(2-methoxyphenyl)pyrazol-4-yl]pyrimidin-2-yl]-[[(3R)-1-methylpyrrolidin-1-ium-3-yl]methyl]amine Formula: C20H25N6O+ MolecularWeight: 365.4521

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(C1)CNC2=NC=CC(=N2)C3=CN(N=C3)C4=CC=CC=C4OC

Isomeric SMILES

C[NH+]1CC[C@@H](C1)CNC2=NC=CC(=N2)C3=CN(N=C3)C4=CC=CC=C4OC

InChI

InChI=1S/C20H24N6O/c1-25-10-8-15(13-25)11-22-20-21-9-7-17(24-20)16-12-23-26(14-16)18-5-3-4-6-19(18)27-2/h3-7,9,12,14-15H,8,10-11,13H2,1-2H3,(H,21,22,24)/p+1/t15-/m1/s1