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

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-fluorophenyl)-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-fluorophenyl)-1-phenylpyrazole-4-carboxamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-fluorophenyl)-1-phenyl-pyrazole-4-carboxamide Formula: C25H20FN3O3 MolecularWeight: 429.443003

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20FN3O3/c26-18-9-7-17(8-10-18)24-21(16-29(28-24)20-5-2-1-3-6-20)25(30)27-19-11-12-22-23(15-19)32-14-4-13-31-22/h1-3,5-12,15-16H,4,13-14H2,(H,27,30)