2-(1,3-benzodioxol-5-yl)-N-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamide

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]ethanamide Openeye Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]methyl]acetamide CAS Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidinyl]methyl]acetamide IUPAC Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]methyl]acetamide Traditional Name: 2-(1,3-benzodioxol-5-yl)-N-[[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]methyl]acetamide Formula: C22H24N6O3 MolecularWeight: 420.46436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CNC(=O)CC2=CC3=C(C=C2)OCO3)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

C1CCN(C(C1)CNC(=O)CC2=CC3=C(C=C2)OCO3)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C22H24N6O3/c29-21(12-16-4-5-18-19(11-16)31-15-30-18)25-13-17-3-1-2-9-28(17)20-6-7-24-22(26-20)27-10-8-23-14-27/h4-8,10-11,14,17H,1-3,9,12-13,15H2,(H,25,29)