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

Systemtic Name: 5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Openeye Name: 5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide CAS Name: 5-cyclopropyl-1-[4-(5-methyl-2-furanyl)-2-pyrimidinyl]-N-[[1-(1-piperidin-1-iumyl)cyclopentyl]methyl]-4-pyrazolecarboxamide IUPAC Name: 5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Traditional Name: 5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]-N-[(1-piperidin-1-ium-1-ylcyclopentyl)methyl]pyrazole-4-carboxamide Formula: C27H35N6O2+ MolecularWeight: 475.6058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCC4(CCCC4)[NH+]5CCCCC5)C6CC6

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCC4(CCCC4)[NH+]5CCCCC5)C6CC6

InChI

InChI=1S/C27H34N6O2/c1-19-7-10-23(35-19)22-11-14-28-26(31-22)33-24(20-8-9-20)21(17-30-33)25(34)29-18-27(12-3-4-13-27)32-15-5-2-6-16-32/h7,10-11,14,17,20H,2-6,8-9,12-13,15-16,18H2,1H3,(H,29,34)/p+1