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

Systemtic Name: 5-methyl-4-(2-methylpyrazol-3-yl)-N-[(2R)-2-pyridin-3-yl-2-pyrrolidin-1-ium-1-yl-ethyl]pyrimidin-2-amine Openeye Name: 5-methyl-4-(2-methylpyrazol-3-yl)-N-[(2R)-2-(3-pyridyl)-2-pyrrolidin-1-ium-1-yl-ethyl]pyrimidin-2-amine CAS Name: 5-methyl-4-(2-methyl-3-pyrazolyl)-N-[(2R)-2-(3-pyridinyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-2-pyrimidinamine IUPAC Name: 5-methyl-4-(2-methylpyrazol-3-yl)-N-[(2R)-2-pyridin-3-yl-2-pyrrolidin-1-ium-1-ylethyl]pyrimidin-2-amine Traditional Name: [5-methyl-4-(2-methylpyrazol-3-yl)pyrimidin-2-yl]-[(2R)-2-(3-pyridyl)-2-pyrrolidin-1-ium-1-yl-ethyl]amine Formula: C20H26N7+ MolecularWeight: 364.46734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(N=C1C2=CC=NN2C)NCC(C3=CN=CC=C3)[NH+]4CCCC4

Isomeric SMILES

CC1=CN=C(N=C1C2=CC=NN2C)NC[C@@H](C3=CN=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C20H25N7/c1-15-12-22-20(25-19(15)17-7-9-24-26(17)2)23-14-18(27-10-3-4-11-27)16-6-5-8-21-13-16/h5-9,12-13,18H,3-4,10-11,14H2,1-2H3,(H,22,23,25)/p+1/t18-/m0/s1