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

Systemtic Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidine-3-carboxamide Openeye Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidine-3-carboxamide CAS Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(1,3-benzodioxol-5-yl)ethyl]-1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidine-3-carboxamide Traditional Name: N-homopiperonyl-1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)nipecotamide Formula: C23H26N6O3 MolecularWeight: 434.49094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCC(C3)C(=O)NCCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCC(C3)C(=O)NCCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H26N6O3/c1-16-11-21(27-23(26-16)29-10-8-24-14-29)28-9-2-3-18(13-28)22(30)25-7-6-17-4-5-19-20(12-17)32-15-31-19/h4-5,8,10-12,14,18H,2-3,6-7,9,13,15H2,1H3,(H,25,30)