Chem
J-GLOBAL ID:201707009532964709
Nikkaji number:J3.625.590K
4-[4-[4-[3-(Trifluoromethyl)-4-chlorophenoxy]-3,5-difluorobenzyloxy]-1-methyl-1,2-dihydro-2-oxopyrimidine-6-yl]thiomorpholine 1,1-dioxide
4-[4-[4-[3-(トリフルオロメチル)-4-クロロフェノキシ]-3,5-ジフルオロベンジルオキシ]-1-メチル-1,2-ジヒドロ-2-オキソピリミジン-6-イル]チオモルホリン1,1-ジオキシド
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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:
C23 H19 ClF5 N3 O3 [O-]2 [S+2]
Molecular formula furigana:
C23-H19-CL-F5-N3-O5-S
Molecular weight:
579.920
InChI:
InChI=1S/C23H19ClF5N3O5S/c1-31-20(32-4-6-38(34,35)7-5-32)11-19(30-22(31)33)36-12-13-8-17(25)21(18(26)9-13)37-14-2-3-16(24)15(10-14)23(27,28)29/h2-3,8-11H,4-7,12H2,1H3
InChI key:
FLCSHCSBIFPQJJ-UHFFFAOYSA-N
SMILES:
Cn1c(cc(OCc2cc(F)c(Oc3ccc(Cl)c(c3)C(F)(F)F)c(F)c2)nc1=O)N1CC[S+2]([O-])([O-])CC1
Systematic name (3):
4-[4-[4-[3-(トリフルオロメチル)-4-クロロフェノキシ]-3,5-ジフルオロベンジルオキシ]-1-メチル-1,2-ジヒドロ-2-オキソピリミジン-6-イル]チオモルホリン1,1-ジオキシド
4-[6-({4-[4-クロロ-3-(トリフルオロメチル)フェノキシ]-3,5-ジフルオロフェニル}メトキシ)-3-メチル-2-オキソ-2,3-ジヒドロピリミジン-4-イル]チオモルホリン-1,1-ジイウム-1,1-ビス(オラート)
4-[6-({4-[4-chloro-3-(trifluoromethyl)phenoxy]-3,5-difluorophenyl}methoxy)-3-methyl-2-oxo-2,3-dihydropyrimidin-4-yl]thiomorpholine-1,1-diium-1,1-bis(olate)
Other name (1):
4-[4-[4-[3-(Trifluoromethyl)-4-chlorophenoxy]-3,5-difluorobenzyloxy]-1-methyl-1,2-dihydro-2-oxopyrimidine-6-yl]thiomorpholine 1,1-dioxide
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