2-[1-[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidin-4-yl]ethyl-dimethyl-azanium

Systemtic Name: 2-[1-[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]carbonylpiperidin-4-yl]ethyl-dimethyl-azanium Openeye Name: 2-[1-[5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazole-4-carbonyl]-4-piperidyl]ethyl-dimethyl-ammonium CAS Name: 2-[1-[[5-cyclopropyl-1-[4-(5-methyl-2-furanyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-4-piperidinyl]ethyl-dimethylammonium IUPAC Name: 2-[1-[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazole-4-carbonyl]piperidin-4-yl]ethyl-dimethylazanium Traditional Name: 2-[1-[5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazole-4-carbonyl]-4-piperidyl]ethyl-dimethyl-ammonium Formula: C25H33N6O2+ MolecularWeight: 449.56852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCC(CC4)CC[NH+](C)C)C5CC5

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CCC(CC4)CC[NH+](C)C)C5CC5

InChI

InChI=1S/C25H32N6O2/c1-17-4-7-22(33-17)21-8-12-26-25(28-21)31-23(19-5-6-19)20(16-27-31)24(32)30-14-10-18(11-15-30)9-13-29(2)3/h4,7-8,12,16,18-19H,5-6,9-11,13-15H2,1-3H3/p+1