7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C34H31N5O4S
InChI: InChI=1/C34H31N5O4S/c1-2-3-4-10-19-41-26-17-15-23(16-18-26)31-24(21-38(36-31)25-11-6-5-7-12-25)20-30-33(40)39-34(44-30)35-32(37-39)29-22-42-27-13-8-9-14-28(27)43-29/h5-9,11-18,20-21,29H,2-4,10,19,22H2,1H3
InChIKey: InChIKey=MTBFDVXIGXMHTE-UHFFFAOYAS
SMILES: CCCCCCOC1=CC=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5COC6=CC=CC=C6O5)S3)C7=CC=CC=C7
Names:
7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(4-hexoxyphenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Registries:
PubChem CID 4507118
PubChem ID 6631534
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|