Chem
J-GLOBAL ID：201507077046136837   Nikkaji number：J3.355.595D

2-[[(R)-1-[2-[3-(2-Fluoroethoxy)-4-methoxyphenyl]-5-methyl-4-thiazolyl]ethyl]thio]-4,6-pyrimidinediamine

2-[[(R)-1-[2-[3-(2-フルオロエトキシ)-4-メトキシフェニル]-5-メチル-4-チアゾリル]エチル]チオ]-4,6-ピリミジンジアミン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C19H22FN5O2S2
Molecular formula furigana： C19-H22-F-N5-O2-S2
Molecular weight： 435.540
InChI： InChI=1S/C19H22FN5O2S2/c1-10-17(11(2)29-19-23-15(21)9-16(22)24-19)25-18(28-10)12-4-5-13(26-3)14(8-12)27-7-6-20/h4-5,8-9,11H,6-7H2,1-3H3,(H4,21,22,23,24)/t11-/m1/s1
InChI key： PLRSHXVGFPURIR-LLVKDONJSA-N
SMILES： COc1ccc(cc1OCCF)c1nc([C@@H](C)Sc2nc(N)cc(N)n2)c(C)s1
Systematic name  (3)：
  • 2-[[(R)-1-[2-[3-(2-フルオロエトキシ)-4-メトキシフェニル]-5-メチル-4-チアゾリル]エチル]チオ]-4,6-ピリミジンジアミン
  • 2-{[(1R)-1-{2-[3-(2-フルオロエトキシ)-4-メトキシフェニル]-5-メチル-1,3-チアゾール-4-イル}エチル]スルファニル}ピリミジン-4,6-ジアミン
  • 2-{[(1R)-1-{2-[3-(2-fluoroethoxy)-4-methoxyphenyl]-5-methyl-1,3-thiazol-4-yl}ethyl]sulfanyl}pyrimidine-4,6-diamine
Other name (1)：
  • 2-[[(R)-1-[2-[3-(2-Fluoroethoxy)-4-methoxyphenyl]-5-methyl-4-thiazolyl]ethyl]thio]-4,6-pyrimidinediamine
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