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Amb19953221

Duplicate ID
Molecule Name 10,10-dimethyl-6-(2-methylprop-2-en-1-yl)-2-(pyridin-4-yl)-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
10,10-dimethyl-6-(2-methylallyl)-2-(pyridin-4-yl)-6,8,10,11-tetrahydro-5H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-one
SmilesCC(=C)CN1C(=O)[n]2[n]c([n]c2-c2c1[s]c1COC(C)(C)Cc21)-c1cc[n]cc1
InchiKeyYAWJMJXGEUTTLZ-UHFFFAOYSA-N
InChi InChI=1S/C21H21N5O2S/c1-12(2)10-25-19-16(14-9-21(3,4)28-11-15(14)29-19)18-23-17(24-26(18)20(25)27)13-5-7-22-8-6-13/h5-8H,1,9-11H2,2-4H3
Formula C21H21N5O2S
Molecular weight 407.489
Rings 5
logP 3.5951
PSA 102.55
MR 114.432
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