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

Systemtic Name: 4-bromanyl-N-[(E)-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-bromo-N-[(E)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-bromo-N-[(E)-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 4-bromo-N-[(E)-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-bromo-N-[(E)-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]methyleneamino]benzamide Formula: C22H16BrN5O MolecularWeight: 446.29934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)C=NNC(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CN=CC=C3)/C=N/NC(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H16BrN5O/c23-19-10-8-16(9-11-19)22(29)26-25-14-18-15-28(20-6-2-1-3-7-20)27-21(18)17-5-4-12-24-13-17/h1-15H,(H,26,29)/b25-14+