N-[(E)-(5-bromanylfuran-2-yl)methylideneamino]-5,5-diphenyl-1,4-dihydropyrazole-3-carboxamide

Systemtic Name: N-[(E)-(5-bromanylfuran-2-yl)methylideneamino]-5,5-diphenyl-1,4-dihydropyrazole-3-carboxamide Openeye Name: N-[(E)-(5-bromo-2-furyl)methyleneamino]-5,5-diphenyl-1,4-dihydropyrazole-3-carboxamide CAS Name: N-[(E)-(5-bromo-2-furanyl)methylideneamino]-5,5-diphenyl-1,4-dihydropyrazole-3-carboxamide IUPAC Name: N-[(E)-(5-bromofuran-2-yl)methylideneamino]-5,5-diphenyl-1,4-dihydropyrazole-3-carboxamide Traditional Name: N-[(E)-(5-bromo-2-furyl)methyleneamino]-5,5-diphenyl-2-pyrazoline-3-carboxamide Formula: C21H17BrN4O2 MolecularWeight: 437.28928

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NNC1(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NN=CC4=CC=C(O4)Br

Isomeric SMILES

C1C(=NNC1(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)N/N=C/C4=CC=C(O4)Br

InChI

InChI=1S/C21H17BrN4O2/c22-19-12-11-17(28-19)14-23-25-20(27)18-13-21(26-24-18,15-7-3-1-4-8-15)16-9-5-2-6-10-16/h1-12,14,26H,13H2,(H,25,27)/b23-14+