4-bromanyl-N-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]benzamide

Systemtic Name: 4-bromanyl-N-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-bromo-N-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]benzamide CAS Name: 4-bromo-N-[(E)-(3,5-dimethyl-1-phenyl-4-pyrazolyl)methylideneamino]benzamide IUPAC Name: 4-bromo-N-[(E)-(3,5-dimethyl-1-phenylpyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-bromo-N-[(E)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyleneamino]benzamide Formula: C19H17BrN4O MolecularWeight: 397.26848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N/NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4O/c1-13-18(14(2)24(23-13)17-6-4-3-5-7-17)12-21-22-19(25)15-8-10-16(20)11-9-15/h3-12H,1-2H3,(H,22,25)/b21-12+