3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-1-methyl-pyrazole-4-carboxamide

Systemtic Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-1-methyl-pyrazole-4-carboxamide Openeye Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-(furan-2-carbonyl)-4-piperidyl]-1-methyl-pyrazole-4-carboxamide CAS Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-1-methyl-4-pyrazolecarboxamide IUPAC Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-(furan-2-carbonyl)piperidin-4-yl]-1-methylpyrazole-4-carboxamide Traditional Name: 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-N-[1-(2-furoyl)-4-piperidyl]-1-methyl-pyrazole-4-carboxamide Formula: C24H26N4O5 MolecularWeight: 450.48704

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CN1C=C(C(=N1)C2=CC3=C(C=C2)OCCCO3)C(=O)NC4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C24H26N4O5/c1-27-15-18(22(26-27)16-5-6-19-21(14-16)33-13-3-12-31-19)23(29)25-17-7-9-28(10-8-17)24(30)20-4-2-11-32-20/h2,4-6,11,14-15,17H,3,7-10,12-13H2,1H3,(H,25,29)