N-[(E)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-bromanyl-benzamide

Systemtic Name: N-[(E)-[3-(1-benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-bromanyl-benzamide Openeye Name: N-[(E)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-bromo-benzamide CAS Name: N-[(E)-[3-(2-benzofuranyl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-bromobenzamide IUPAC Name: N-[(E)-[3-(1-benzofuran-2-yl)-1-phenylpyrazol-4-yl]methylideneamino]-2-bromobenzamide Traditional Name: N-[(E)-[3-(benzofuran-2-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-bromo-benzamide Formula: C25H17BrN4O2 MolecularWeight: 485.33208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)C=NNC(=O)C5=CC=CC=C5Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC4=CC=CC=C4O3)/C=N/NC(=O)C5=CC=CC=C5Br

InChI

InChI=1S/C25H17BrN4O2/c26-21-12-6-5-11-20(21)25(31)28-27-15-18-16-30(19-9-2-1-3-10-19)29-24(18)23-14-17-8-4-7-13-22(17)32-23/h1-16H,(H,28,31)/b27-15+