1-[4-(1-benzofuran-2-yl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-methyl-pyrazole-4-carboxamide

Systemtic Name: 1-[4-(1-benzofuran-2-yl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-methyl-pyrazole-4-carboxamide Openeye Name: 1-[4-(benzofuran-2-yl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-methyl-pyrazole-4-carboxamide CAS Name: 1-[4-(2-benzofuranyl)-2-pyrimidinyl]-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-5-methyl-4-pyrazolecarboxamide IUPAC Name: 1-[4-(1-benzofuran-2-yl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-methylpyrazole-4-carboxamide Traditional Name: 1-[4-(benzofuran-2-yl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]-5-methyl-pyrazole-4-carboxamide Formula: C24H27N6O2+ MolecularWeight: 431.51018

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC5=CC=CC=C5O4)C

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC5=CC=CC=C5O4)C

InChI

InChI=1S/C24H26N6O2/c1-3-29-12-6-8-18(29)14-26-23(31)19-15-27-30(16(19)2)24-25-11-10-20(28-24)22-13-17-7-4-5-9-21(17)32-22/h4-5,7,9-11,13,15,18H,3,6,8,12,14H2,1-2H3,(H,26,31)/p+1/t18-/m0/s1