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Amb1151131

Duplicate ID
SmilesO=c1c2c(sc3c2CCCC3)nc2n1n1cnnc1c1c2cccc1
InchiKeyGAQNXCACPXHMEW-UHFFFAOYSA-N
InChi InChI=1S/C18H13N5OS/c24-18-14-12-7-3-4-8-13(12)25-17(14)20-15-10-5-1-2-6-11(10)16-21-19-9-22(16)23(15)18/h1-2,5-6,9H,3-4,7-8H2
Formula C18H13N5OS
Molecular weight 347.394
Rings 6
logP 2.9839
PSA 92.8
MR 98.328
Resynthesis
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