CHEBI:119880 - 5-amino-N'-[(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-cyano-3-methyl-2-thiophenecarbohydrazide

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ChEBI Name 5-amino-N'-[(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-cyano-3-methyl-2-thiophenecarbohydrazide
ChEBI ID CHEBI:119880
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C14H11BrN4O2S
Net Charge 0
Average Mass 379.233
Monoisotopic Mass 377.97861
InChI InChI=1S/C14H11BrN4O2S/c1-7-9(5-16)13(17)22-12(7)14(21)19-18-6-8-2-3-11(20)10(15)4-8/h2-4,6,18H,17H2,1H3,(H,19,21)
InChIKey QIUVOCFVMCFRCX-UHFFFAOYSA-N
SMILES CC1=C(SC(=C1C#N)N)C(=O)NNC=C2C=CC(=O)C(=C2)Br
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 5-amino-N'-[(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-cyano-3-methyl-2-thiophenecarbohydrazide (CHEBI:119880) is a aromatic amine (CHEBI:33860)
5-amino-N'-[(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-4-cyano-3-methyl-2-thiophenecarbohydrazide (CHEBI:119880) is a thiophenes (CHEBI:26961)
Manual Xref Database
LSM-31324 LINCS
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