2-[1-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperidin-2-yl]-N-octyl-ethanamide

Systemtic Name: 2-[1-(2-imidazol-1-yl-6-propan-2-yl-pyrimidin-4-yl)piperidin-2-yl]-N-octyl-ethanamide Openeye Name: 2-[1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-2-piperidyl]-N-octyl-acetamide CAS Name: 2-[1-[2-(1-imidazolyl)-6-propan-2-yl-4-pyrimidinyl]-2-piperidinyl]-N-octylacetamide IUPAC Name: 2-[1-(2-imidazol-1-yl-6-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]-N-octylacetamide Traditional Name: 2-[1-(2-imidazol-1-yl-6-isopropyl-pyrimidin-4-yl)-2-piperidyl]-N-octyl-acetamide Formula: C25H40N6O MolecularWeight: 440.6247

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)CC1CCCCN1C2=NC(=NC(=C2)C(C)C)N3C=CN=C3

Isomeric SMILES

CCCCCCCCNC(=O)CC1CCCCN1C2=NC(=NC(=C2)C(C)C)N3C=CN=C3

InChI

InChI=1S/C25H40N6O/c1-4-5-6-7-8-10-13-27-24(32)17-21-12-9-11-15-31(21)23-18-22(20(2)3)28-25(29-23)30-16-14-26-19-30/h14,16,18-21H,4-13,15,17H2,1-3H3,(H,27,32)