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Reference, SMILES, CAS, Chemical name...

Amb17775907

Duplicate ID
SmilesO=c1n2C(c3cccs3)C3=C(N=c2s\c1=C\c1ccc2OCOc2c1)c1ccccc1CC3
InchiKeyWYJHVGQSBDKKGR-LPYMAVHISA-N
InChi InChI=1S/C26H18N2O3S2/c29-25-22(13-15-7-10-19-20(12-15)31-14-30-19)33-26-27-23-17-5-2-1-4-16(17)8-9-18(23)24(28(25)26)21-6-3-11-32-21/h1-7,10-13,24H,8-9,14H2/b22-13+
Formula C26H18N2O3S2
Molecular weight 470.563
Rings 7
logP 3.5445
PSA 109.3
MR 133.405
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