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

Systemtic Name: 4-bromanyl-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylideneamino]benzamide Openeye Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]methylideneamino]benzamide IUPAC Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]methylideneamino]benzamide Traditional Name: 4-bromo-N-[(E)-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methyleneamino]benzamide Formula: C25H21BrN4O3 MolecularWeight: 505.36324

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=NNC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2/C=N/NC(=O)C3=CC=C(C=C3)Br)C4=CC=CC=C4)OC

InChI

InChI=1S/C25H21BrN4O3/c1-32-22-13-10-18(14-23(22)33-2)24-19(16-30(29-24)21-6-4-3-5-7-21)15-27-28-25(31)17-8-11-20(26)12-9-17/h3-16H,1-2H3,(H,28,31)/b27-15+