N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-1-ium-3-yl]methyl]-4-(1-methylpyrazol-4-yl)pyrimidin-2-amine

Systemtic Name: N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-1-ium-3-yl]methyl]-4-(1-methylpyrazol-4-yl)pyrimidin-2-amine Openeye Name: N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-1-ium-3-yl]methyl]-4-(1-methylpyrazol-4-yl)pyrimidin-2-amine CAS Name: N-[[(3R)-1-(3-methoxypropyl)-3-pyrrolidin-1-iumyl]methyl]-4-(1-methyl-4-pyrazolyl)-2-pyrimidinamine IUPAC Name: N-[[(3R)-1-(3-methoxypropyl)pyrrolidin-1-ium-3-yl]methyl]-4-(1-methylpyrazol-4-yl)pyrimidin-2-amine Traditional Name: [(3R)-1-(3-methoxypropyl)pyrrolidin-1-ium-3-yl]methyl-[4-(1-methylpyrazol-4-yl)pyrimidin-2-yl]amine Formula: C17H27N6O+ MolecularWeight: 331.43588

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C2=NC(=NC=C2)NCC3CC[NH+](C3)CCCOC

Isomeric SMILES

CN1C=C(C=N1)C2=NC(=NC=C2)NC[C@H]3CC[NH+](C3)CCCOC

InChI

InChI=1S/C17H26N6O/c1-22-13-15(11-20-22)16-4-6-18-17(21-16)19-10-14-5-8-23(12-14)7-3-9-24-2/h4,6,11,13-14H,3,5,7-10,12H2,1-2H3,(H,18,19,21)/p+1/t14-/m1/s1