5-(1-cyclobutylcarbonylpiperidin-3-yl)-3-(phenylmethyl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-(1-cyclobutylcarbonylpiperidin-3-yl)-3-(phenylmethyl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-benzyl-5-[1-(cyclobutanecarbonyl)-3-piperidyl]-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 5-[1-[cyclobutyl(oxo)methyl]-3-piperidinyl]-3-(phenylmethyl)-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-benzyl-5-[1-(cyclobutanecarbonyl)piperidin-3-yl]-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-benzyl-5-[1-(cyclobutanecarbonyl)-3-piperidyl]-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C21H24N6O2 MolecularWeight: 392.45426

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)N2CCCC(C2)C3=NC(=O)C4=NNN(C4=N3)CC5=CC=CC=C5

Isomeric SMILES

C1CC(C1)C(=O)N2CCCC(C2)C3=NC(=O)C4=NNN(C4=N3)CC5=CC=CC=C5

InChI

InChI=1S/C21H24N6O2/c28-20-17-19(27(25-24-17)12-14-6-2-1-3-7-14)22-18(23-20)16-10-5-11-26(13-16)21(29)15-8-4-9-15/h1-3,6-7,15-16,25H,4-5,8-13H2