N-[2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperidinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidin-2-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]ethyl]-piperonylamide Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3CCNC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3CCNC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N6O3/c1-16-12-21(27-23(26-16)28-11-9-24-14-28)29-10-3-2-4-18(29)7-8-25-22(30)17-5-6-19-20(13-17)32-15-31-19/h5-6,9,11-14,18H,2-4,7-8,10,15H2,1H3,(H,25,30)