N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide

Systemtic Name: N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]ethanamide Openeye Name: N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide CAS Name: N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-[2-(1-imidazolyl)-4-pyrimidinyl]-2-piperidinyl]acetamide IUPAC Name: N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)piperidin-2-yl]acetamide Traditional Name: N-[2-(4H-1,3-benzodioxin-5-yl)ethyl]-2-[1-(2-imidazol-1-ylpyrimidin-4-yl)-2-piperidyl]acetamide Formula: C24H28N6O3 MolecularWeight: 448.51752

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CC(=O)NCCC2=C3COCOC3=CC=C2)C4=NC(=NC=C4)N5C=CN=C5

Isomeric SMILES

C1CCN(C(C1)CC(=O)NCCC2=C3COCOC3=CC=C2)C4=NC(=NC=C4)N5C=CN=C5

InChI

InChI=1S/C24H28N6O3/c31-23(26-9-7-18-4-3-6-21-20(18)15-32-17-33-21)14-19-5-1-2-12-30(19)22-8-10-27-24(28-22)29-13-11-25-16-29/h3-4,6,8,10-11,13,16,19H,1-2,5,7,9,12,14-15,17H2,(H,26,31)