7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(3-methyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-4-thia-1,6,8-triazabicyclo[3.3.0]octa-5,7-dien-2-one
Molecular Formula:
C32H27N5O4S
InChI: InChI=1/C32H27N5O4S/c1-3-15-39-24-14-13-21(16-20(24)2)29-22(18-36(34-29)23-9-5-4-6-10-23)17-28-31(38)37-32(42-28)33-30(35-37)27-19-40-25-11-7-8-12-26(25)41-27/h4-14,16-18,27H,3,15,19H2,1-2H3
InChIKey: InChIKey=CLAQIQYLZOROPK-UHFFFAOYAQ
SMILES: CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(=NC(=N4)C5COC6=CC=CC=C6O5)S3)C7=CC=CC=C7)C
Names:
7-(7,10-dioxabicyclo[4.4.0]deca-1,3,5-trien-9-yl)-3-[[3-(3-methyl-4-propoxy-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 4505171
PubChem ID 6629321
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