N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-imidazol-1-yl-6-methoxy-pyrimidin-4-yl)piperidin-2-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-imidazol-1-yl-6-methoxy-pyrimidin-4-yl)piperidin-2-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-imidazol-1-yl-6-methoxy-pyrimidin-4-yl)-2-piperidyl]acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-[2-(1-imidazolyl)-6-methoxy-4-pyrimidinyl]-2-piperidinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[4-(2-imidazol-1-yl-6-methoxypyrimidin-4-yl)piperidin-2-yl]acetamide Traditional Name: 2-[4-(2-imidazol-1-yl-6-methoxy-pyrimidin-4-yl)-2-piperidyl]-N-piperonyl-acetamide Formula: C23H26N6O4 MolecularWeight: 450.49034

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC(=NC(=C1)C2CCNC(C2)CC(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

Isomeric SMILES

COC1=NC(=NC(=C1)C2CCNC(C2)CC(=O)NCC3=CC4=C(C=C3)OCO4)N5C=CN=C5

InChI

InChI=1S/C23H26N6O4/c1-31-22-11-18(27-23(28-22)29-7-6-24-13-29)16-4-5-25-17(9-16)10-21(30)26-12-15-2-3-19-20(8-15)33-14-32-19/h2-3,6-8,11,13,16-17,25H,4-5,9-10,12,14H2,1H3,(H,26,30)