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Amb767731

Duplicate ID
Molecule Name 10,10-dimethyl-2-(4-nitrophenyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
Smiles[O-][N+](=O)c1ccc(cc1)c1nn2c(n1)c1c(nc2)sc2c1CC(C)(C)OC2
InchiKeyIFBVNQXWQDGBKV-UHFFFAOYSA-N
InChi InChI=1S/C18H15N5O3S/c1-18(2)7-12-13(8-26-18)27-17-14(12)16-20-15(21-22(16)9-19-17)10-3-5-11(6-4-10)23(24)25/h3-6,9H,7-8H2,1-2H3
Formula C18H15N5O3S
Molecular weight 381.408
Rings 5
logP 4.2887
PSA 126.37
MR 103.785
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