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Amb1047740

Duplicate ID
Molecule Name 10-({[1-(1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]thio}acetyl)-2-chloro-10H-phenothiazine
SmilesClc1ccc2c(c1)N(C(=O)CSc1nnnn1c1ccc3c(c1)OCO3)c1c(S2)cccc1
InchiKeyYVYRMSSYGZBQEX-UHFFFAOYSA-N
InChi InChI=1S/C22H14ClN5O3S2/c23-13-5-8-20-16(9-13)27(15-3-1-2-4-19(15)33-20)21(29)11-32-22-24-25-26-28(22)14-6-7-17-18(10-14)31-12-30-17/h1-10H,11-12H2
Formula C22H14ClN5O3S2
Molecular weight 495.961
Rings 6
logP 5.031
PSA 132.97
MR 127.979
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