3-(2-oxidanyl-3-piperidin-1-yl-propyl)-5-phenyl-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-(2-oxidanyl-3-piperidin-1-yl-propyl)-5-phenyl-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-[2-hydroxy-3-(1-piperidyl)propyl]-5-phenyl-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-[2-hydroxy-3-(1-piperidinyl)propyl]-5-phenyl-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-(2-hydroxy-3-piperidin-1-ylpropyl)-5-phenyl-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-(2-hydroxy-3-piperidino-propyl)-5-phenyl-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(CN2C3=NC(=NC(=O)C3=NN2)C4=CC=CC=C4)O

Isomeric SMILES

C1CCN(CC1)CC(CN2C3=NC(=NC(=O)C3=NN2)C4=CC=CC=C4)O

InChI

InChI=1S/C18H22N6O2/c25-14(11-23-9-5-2-6-10-23)12-24-17-15(21-22-24)18(26)20-16(19-17)13-7-3-1-4-8-13/h1,3-4,7-8,14,22,25H,2,5-6,9-12H2