Chem
J-GLOBAL ID：201407069360790355   Nikkaji number：J3.265.012K

Satavaptan

サタバプタン
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： C32H45N3O9S2
Molecular formula furigana： C32-H45-N3-O9-S2
Molecular weight： 679.840
InChI： InChI=1S/C32H45N3O9S2/c1-6-43-24-7-9-27-26(21-24)32(13-11-23(12-14-32)44-20-17-34-15-18-42-19-16-34)30(36)35(27)46(39,40)29-10-8-25(22-28(29)41-5)45(37,38)33-31(2,3)4/h7-10,21-23,33H,6,11-20H2,1-5H3
InChI key： PLEKHTBMYGDTHM-UHFFFAOYSA-N
SMILES： CCOc1ccc2N(C(=O)C3(CCC(CC3)OCCN3CCOCC3)c2c1)S(=O)(=O)c1ccc(cc1OC)S(=O)(=O)NC(C)(C)C
Systematic name  (3)：
  • N-(tert-ブチル)-4-[[2-オキソ-5-エトキシ-4′β-(2-モルホリノエトキシ)スピロ[1H-インドール-3(2H),1′-シクロヘキサン]]-1-イルスルホニル]-3-メトキシベンゼンスルホンアミド
  • N-tert-ブチル-4-({5'-エトキシ-4-[2-(モルホリン-4-イル)エトキシ]-2'-オキソ-1',2'-ジヒドロスピロ[シクロヘキサン-1,3'-インドール]-1'-イル}スルホニル)-3-メトキシベンゼン-1-スルホンアミド
  • N-tert-butyl-4-({5'-ethoxy-4-[2-(morpholin-4-yl)ethoxy]-2'-oxo-1',2'-dihydrospiro[cyclohexane-1,3'-indol]-1'-yl}sulfonyl)-3-methoxybenzene-1-sulfonamide
Other name (3)：
  • N-(tert-Butyl)-4-[[2-oxo-5-ethoxy-4′β-(2-morpholinoethoxy)spiro[1H-indole-3(2H),1′-cyclohexane]]-1-ylsulfonyl]-3-methoxybenzenesulfonamide
  • サタバプタン
  • Satavaptan
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