5-(furan-2-yl)-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide

Systemtic Name: 5-(furan-2-yl)-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Openeye Name: 5-(2-furyl)-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide CAS Name: 5-(2-furanyl)-1-[4-(2-methoxyphenyl)-2-pyrimidinyl]-N-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 5-(furan-2-yl)-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Traditional Name: 5-(2-furyl)-1-[4-(2-methoxyphenyl)pyrimidin-2-yl]-N-(2-morpholin-4-ium-4-ylethyl)pyrazole-4-carboxamide Formula: C25H27N6O4+ MolecularWeight: 475.51968

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCC[NH+]4CCOCC4)C5=CC=CO5

Isomeric SMILES

COC1=CC=CC=C1C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)NCC[NH+]4CCOCC4)C5=CC=CO5

InChI

InChI=1S/C25H26N6O4/c1-33-21-6-3-2-5-18(21)20-8-9-27-25(29-20)31-23(22-7-4-14-35-22)19(17-28-31)24(32)26-10-11-30-12-15-34-16-13-30/h2-9,14,17H,10-13,15-16H2,1H3,(H,26,32)/p+1