1,3-benzodioxol-5-yl-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]methanone

Systemtic Name: 1,3-benzodioxol-5-yl-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]methanone Openeye Name: 1,3-benzodioxol-5-yl-[3-[5-(4-pyridyl)pyrimidin-4-yl]-1-piperidyl]methanone CAS Name: 1,3-benzodioxol-5-yl-[3-(5-pyridin-4-yl-4-pyrimidinyl)-1-piperidinyl]methanone IUPAC Name: 1,3-benzodioxol-5-yl-[3-(5-pyridin-4-ylpyrimidin-4-yl)piperidin-1-yl]methanone Traditional Name: 1,3-benzodioxol-5-yl-[3-[5-(4-pyridyl)pyrimidin-4-yl]piperidino]methanone Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)C4=NC=NC=C4C5=CC=NC=C5

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC3=C(C=C2)OCO3)C4=NC=NC=C4C5=CC=NC=C5

InChI

InChI=1S/C22H20N4O3/c27-22(16-3-4-19-20(10-16)29-14-28-19)26-9-1-2-17(12-26)21-18(11-24-13-25-21)15-5-7-23-8-6-15/h3-8,10-11,13,17H,1-2,9,12,14H2