N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-phenyl-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C24H20N4O3 MolecularWeight: 412.4406

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC(=O)C3=CN(N=C3C4=CN=CC=C4)C5=CC=CC=C5)OC1

InChI

InChI=1S/C24H20N4O3/c29-24(26-18-9-10-21-22(14-18)31-13-5-12-30-21)20-16-28(19-7-2-1-3-8-19)27-23(20)17-6-4-11-25-15-17/h1-4,6-11,14-16H,5,12-13H2,(H,26,29)