Chem
J-GLOBAL ID:201907001171039880
Nikkaji number:J3.737.946H
Cilofexor
シロフェクソル
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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:
C28 H22 Cl3 N3 O5
Molecular formula furigana:
C28-H22-CL3-N3-O5
Molecular weight:
586.850
InChI:
InChI=1S/C28H22Cl3N3O5/c29-20-2-1-3-21(30)24(20)25-18(26(39-33-25)15-4-5-15)12-38-17-6-7-19(22(31)11-17)28(37)13-34(14-28)23-10-16(27(35)36)8-9-32-23/h1-3,6-11,15,37H,4-5,12-14H2,(H,35,36)
InChI key:
KZSKGLFYQAYZCO-UHFFFAOYSA-N
SMILES:
n1c(cc(cc1)C(=O)O)N1CC(C1)(O)c1c(cc(cc1)OCc1c(noc1C1CC1)c1c(cccc1Cl)Cl)Cl
Systematic name (3):
2-[3-[2-クロロ-4-[5-シクロプロピル-3-(2,6-ジクロロフェニル)イソオキサゾール-4-イルメトキシ]フェニル]-3-ヒドロキシアゼチジン-1-イル]ピリジン-4-カルボン酸
2-[3-(2-クロロ-4-{[5-シクロプロピル-3-(2,6-ジクロロフェニル)-1,2-オキサゾール-4-イル]メトキシ}フェニル)-3-ヒドロキシアゼチジン-1-イル]ピリジン-4-カルボン酸
2-[3-(2-chloro-4-{[5-cyclopropyl-3-(2,6-dichlorophenyl)-1,2-oxazol-4-yl]methoxy}phenyl)-3-hydroxyazetidin-1-yl]pyridine-4-carboxylic acid
Other name (3):
シロフェクソル
Cilofexor
GS-9674
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