(2E)-3-oxo-4-[[4-phenyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,8,9-triazabicyclo[5.3.0]dec-7-en-10-ylidene)butanenitrile
Molecular Formula:
C29H31N7OS
InChI: InChI=1/C29H31N7OS/c1-29(2,3)21-15-13-20(14-16-21)26-32-34-28(36(26)22-10-6-4-7-11-22)38-19-24(37)23(18-30)27-33-31-25-12-8-5-9-17-35(25)27/h4,6-7,10-11,13-16,33H,5,8-9,12,17,19H2,1-3H3/b27-23-
InChIKey: InChIKey=QJQWUTDCDZDPRV-VYIQYICTBN
SMILES: CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC(=O)C(=C4NN=C5N4CCCCC5)C#N
Names:
(2E)-3-oxo-4-[[4-phenyl-5-(4-tert-butylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-2-(1,8,9-triazabicyclo[5.3.0]dec-7-en-10-ylidene)butanenitrile
Registries:
PubChem CID 6388975
PubChem ID 11609936
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