3-[(3-chlorophenyl)methyl]-5-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-[(3-chlorophenyl)methyl]-5-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-[(3-chlorophenyl)methyl]-5-[1-(furan-2-carbonyl)-4-piperidyl]-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-[(3-chlorophenyl)methyl]-5-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-[(3-chlorophenyl)methyl]-5-[1-(furan-2-carbonyl)piperidin-4-yl]-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-(3-chlorobenzyl)-5-[1-(2-furoyl)-4-piperidyl]-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C21H19ClN6O3 MolecularWeight: 438.86696

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=O)C3=NNN(C3=N2)CC4=CC(=CC=C4)Cl)C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCC1C2=NC(=O)C3=NNN(C3=N2)CC4=CC(=CC=C4)Cl)C(=O)C5=CC=CO5

InChI

InChI=1S/C21H19ClN6O3/c22-15-4-1-3-13(11-15)12-28-19-17(25-26-28)20(29)24-18(23-19)14-6-8-27(9-7-14)21(30)16-5-2-10-31-16/h1-5,10-11,14,26H,6-9,12H2