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Amb1051789

Duplicate ID
Molecule Name 10-({[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]thio}acetyl)-2-(trifluoromethyl)-10H-phenothiazine
SmilesO=C(N1c2ccccc2Sc2c1cc(cc2)C(F)(F)F)CSc1nnnn1c1ccc2c(c1)OCO2
InchiKeyAUCUIINBKJBNFL-UHFFFAOYSA-N
InChi InChI=1S/C23H14F3N5O3S2/c24-23(25,26)13-5-8-20-16(9-13)30(15-3-1-2-4-19(15)36-20)21(32)11-35-22-27-28-29-31(22)14-6-7-17-18(10-14)34-12-33-17/h1-10H,11-12H2
Formula C23H14F3N5O3S2
Molecular weight 529.514
Rings 6
logP 5.3964
PSA 132.97
MR 127.971
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