Chem
J-GLOBAL ID：201607017632779068   Nikkaji number：J3.518.821E

Avosentan

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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： C23H21N5O5S
Molecular formula furigana： C23-H21-N5-O5-S
Molecular weight： 479.510
InChI： InChI=1S/C23H21N5O5S/c1-15-8-9-19(25-14-15)34(29,30)28-22-20(33-18-7-5-4-6-17(18)31-2)23(32-3)27-21(26-22)16-10-12-24-13-11-16/h4-14H,1-3H3,(H,26,27,28)
InChI key： YBWLTKFZAOSWSM-UHFFFAOYSA-N
SMILES： COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C)cn2)nc(nc1OC)c1ccncc1
Systematic name  (2)：
  • N-[6-メトキシ-5-(2-メトキシフェノキシ)-2-(ピリジン-4-イル)ピリミジン-4-イル]-5-メチルピリジン-2-スルホンアミド
  • N-[6-methoxy-5-(2-methoxyphenoxy)-2-(pyridin-4-yl)pyrimidin-4-yl]-5-methylpyridine-2-sulfonamide
Other name (3)：
  • N-[6-Methoxy-5-(2-methoxyphenoxy)-2-(pyridine-4-yl)pyrimidine-4-yl]-5-methylpyridine-2-sulfonamide
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  • Avosentan
CAS registry number： 290815-26-8
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