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CHEBI:43159 - 4-({4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl}imino)cyclohexa-2,5-diene-1-carbonitrile

Default Structure
ChEBI IDCHEBI:43159
ChEBI Name4-({4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl}imino)cyclohexa-2,5-diene-1-carbonitrile
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC21H17N7
Net Charge0
Average Mass367.416
Monoisotopic Mass367.15454
SMILES[H]C1=C([H])C([H])(C#N)C([H])=C([H])C1=Nc1nc(N([H])c2nn([H])c(C3([H])C([H])([H])C3([H])[H])c2[H])c2c([H])c([H])c([H])c([H])c2n1
InChIInChI=1S/C21H17N7/c22-12-13-5-9-15(10-6-13)23-21-24-17-4-2-1-3-16(17)20(26-21)25-19-11-18(27-28-19)14-7-8-14/h1-6,9-11,13-14H,7-8H2,(H2,24,25,26,27,28)/b23-15-/t13-/m0/s1
InChIKeySEECYRBHJSWALR-XEUWRUEYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-({4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl}imino)cyclohexa-2,5-diene-1-carbonitrile (CHEBI:43159) is a unclassifieds (CHEBI:27189)
Synonyms  Source
(1R,4Z)-4-({4-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl}imino)cyclohexa-2,5-diene-1-carbonitrilePDBeChem
4-({4-[(5-CYCLOPROPYL-1H-PYRAZOL-3-YL)AMINO]QUINAZOLIN-2-YL}IMINO)CYCLOHEXA-2,5-DIENE-1-CARBONITRILEPDBeChem
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