5-bromanyl-2-[(2E)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzenecarbonitrile

Systemtic Name: 5-bromanyl-2-[(2E)-2-(3-methyl-5-oxidanylidene-1-phenyl-pyrazol-4-ylidene)hydrazinyl]benzenecarbonitrile Openeye Name: 5-bromo-2-[(2E)-2-(3-methyl-5-oxo-1-phenyl-pyrazol-4-ylidene)hydrazino]benzonitrile CAS Name: 5-bromo-2-[(2E)-2-(3-methyl-5-oxo-1-phenyl-4-pyrazolylidene)hydrazinyl]benzonitrile IUPAC Name: 5-bromo-2-[(2E)-2-(3-methyl-5-oxo-1-phenylpyrazol-4-ylidene)hydrazinyl]benzonitrile Traditional Name: 5-bromo-2-[(N'E)-N'-(5-keto-3-methyl-1-phenyl-2-pyrazolin-4-ylidene)hydrazino]benzonitrile Formula: C17H12BrN5O MolecularWeight: 382.21408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=NNC2=C(C=C(C=C2)Br)C#N)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=N/NC2=C(C=C(C=C2)Br)C#N)C3=CC=CC=C3

InChI

InChI=1S/C17H12BrN5O/c1-11-16(17(24)23(22-11)14-5-3-2-4-6-14)21-20-15-8-7-13(18)9-12(15)10-19/h2-9,20H,1H3/b21-16+