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

Systemtic Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)-2-pyrimidinyl]-N-[[(2S)-1-ethyl-2-pyrrolidin-1-iumyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-[4-(2,5-dimethoxyphenyl)pyrimidin-2-yl]-N-[[(2S)-1-ethylpyrrolidin-1-ium-2-yl]methyl]pyrazole-4-carboxamide Formula: C26H33N6O3+ MolecularWeight: 477.57862

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=C(C=CC(=C4)OC)OC)C5CC5

Isomeric SMILES

CC[NH+]1CCC[C@H]1CNC(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=C(C=CC(=C4)OC)OC)C5CC5

InChI

InChI=1S/C26H32N6O3/c1-4-31-13-5-6-18(31)15-28-25(33)21-16-29-32(24(21)17-7-8-17)26-27-12-11-22(30-26)20-14-19(34-2)9-10-23(20)35-3/h9-12,14,16-18H,4-8,13,15H2,1-3H3,(H,28,33)/p+1/t18-/m0/s1