N'-[(Z)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-5-tert-butyl-2-phenyl-pyrazole-3-carbohydrazide

Systemtic Name: N'-[(Z)-(3-bromanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]-5-tert-butyl-2-phenyl-pyrazole-3-carbohydrazide Openeye Name: N'-[(Z)-(3-bromo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]-5-tert-butyl-2-phenyl-pyrazole-3-carbohydrazide CAS Name: N'-[(Z)-(3-bromo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]-5-tert-butyl-2-phenyl-3-pyrazolecarbohydrazide IUPAC Name: N'-[(Z)-(3-bromo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]-5-tert-butyl-2-phenylpyrazole-3-carbohydrazide Traditional Name: N'-[(Z)-(3-bromo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]-5-tert-butyl-2-phenyl-pyrazole-3-carbohydrazide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C(=O)NNC=C2C=C(C=CC2=O)Br)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C(=O)NN/C=C\2/C=C(C=CC2=O)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H21BrN4O2/c1-21(2,3)19-12-17(26(25-19)16-7-5-4-6-8-16)20(28)24-23-13-14-11-15(22)9-10-18(14)27/h4-13,23H,1-3H3,(H,24,28)/b14-13-