(3Z)-7-(4-hexoxyphenyl)-3-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C37H39N5O3S
InChI: InChI=1/C37H39N5O3S/c1-5-6-7-11-20-44-31-17-14-27(15-18-31)35-38-37-42(40-35)36(43)33(46-37)22-29-23-41(30-12-9-8-10-13-30)39-34(29)28-16-19-32(26(4)21-28)45-24-25(2)3/h8-10,12-19,21-23,25H,5-7,11,20,24H2,1-4H3/b33-22-
InChIKey: InChIKey=NTSUVAJCTRSROX-NVMPUMLXBL
SMILES: CCCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=CN(N=C4C5=CC(=C(C=C5)OCC(C)C)C)C6=CC=CC=C6)SC3=N2
Names:
(3Z)-7-(4-hexoxyphenyl)-3-[[3-[3-methyl-4-(2-methylpropoxy)phenyl]-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 6318600
PubChem ID 11598643
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