2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Openeye Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-[6-(1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-[6-(1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-piperidin-1-ylpyrimidin-4-yl)piperazin-1-yl]propan-1-one Traditional Name: 2-(1,3-benzodioxol-5-yloxy)-1-[4-(6-piperidinopyrimidin-4-yl)piperazino]propan-1-one Formula: C23H29N5O4 MolecularWeight: 439.50746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCCC3)OC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C2=NC=NC(=C2)N3CCCCC3)OC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H29N5O4/c1-17(32-18-5-6-19-20(13-18)31-16-30-19)23(29)28-11-9-27(10-12-28)22-14-21(24-15-25-22)26-7-3-2-4-8-26/h5-6,13-15,17H,2-4,7-12,16H2,1H3