1-[4-(furan-2-yl)pyrimidin-2-yl]-5-(methoxymethyl)-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide

Systemtic Name: 1-[4-(furan-2-yl)pyrimidin-2-yl]-5-(methoxymethyl)-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Openeye Name: 1-[4-(2-furyl)pyrimidin-2-yl]-5-(methoxymethyl)-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide CAS Name: 1-[4-(2-furanyl)-2-pyrimidinyl]-5-(methoxymethyl)-N-[[1-(1-piperidin-1-iumyl)cyclopentyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 1-[4-(furan-2-yl)pyrimidin-2-yl]-5-(methoxymethyl)-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Traditional Name: 1-[4-(2-furyl)pyrimidin-2-yl]-5-(methoxymethyl)-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Formula: C25H33N6O3+ MolecularWeight: 465.56792

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C=NN1C2=NC=CC(=N2)C3=CC=CO3)C(=O)NCC4(CCCC4)[NH+]5CCCCC5

Isomeric SMILES

COCC1=C(C=NN1C2=NC=CC(=N2)C3=CC=CO3)C(=O)NCC4(CCCC4)[NH+]5CCCCC5

InChI

InChI=1S/C25H32N6O3/c1-33-17-21-19(16-28-31(21)24-26-12-9-20(29-24)22-8-7-15-34-22)23(32)27-18-25(10-3-4-11-25)30-13-5-2-6-14-30/h7-9,12,15-16H,2-6,10-11,13-14,17-18H2,1H3,(H,27,32)/p+1