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

Systemtic Name: 4-bromanyl-N-[(E)-[3,5-dimethyl-1-(phenylmethyl)pyrazol-4-yl]methylideneamino]benzamide Openeye Name: N-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]-4-bromo-benzamide CAS Name: 4-bromo-N-[(E)-[3,5-dimethyl-1-(phenylmethyl)-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: N-[(E)-(1-benzyl-3,5-dimethylpyrazol-4-yl)methylideneamino]-4-bromobenzamide Traditional Name: N-[(E)-(1-benzyl-3,5-dimethyl-pyrazol-4-yl)methyleneamino]-4-bromo-benzamide Formula: C20H19BrN4O MolecularWeight: 411.29506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC=C2)C)C=NNC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC=C2)C)/C=N/NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H19BrN4O/c1-14-19(12-22-23-20(26)17-8-10-18(21)11-9-17)15(2)25(24-14)13-16-6-4-3-5-7-16/h3-12H,13H2,1-2H3,(H,23,26)/b22-12+