Chem
J-GLOBAL ID：200907000779234436   Nikkaji number：J842.587F

(2R)-2α-(4-Methoxyphenyl)-3α-(butylcarbamoyloxy)-5-[2-(dimethylamino)ethyl]-8-methoxy-2,3-dihydro-1,5-benzothiazepin-4(5H)-one

(2R)-2α-(4-メトキシフェニル)-3α-(ブチルカルバモイルオキシ)-5-[2-(ジメチルアミノ)エチル]-8-メトキシ-2,3-ジヒドロ-1,5-ベンゾチアゼピン-4(5H)-オン
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： C26H35N3O5S
Molecular formula furigana： C26-H35-N3-O5-S
Molecular weight： 501.640
InChI： InChI=1S/C26H35N3O5S/c1-6-7-14-27-26(31)34-23-24(18-8-10-19(32-4)11-9-18)35-22-17-20(33-5)12-13-21(22)29(25(23)30)16-15-28(2)3/h8-13,17,23-24H,6-7,14-16H2,1-5H3,(H,27,31)/t23-,24+/m0/s1
InChI key： DXDOWJKHCKKBNS-BJKOFHAPSA-N
SMILES： CCCCNC(=O)O[C@H]1[C@H](Sc2cc(OC)ccc2N(CCN(C)C)C1=O)c1ccc(OC)cc1
Systematic name  (3)：
  • (2R)-2α-(4-メトキシフェニル)-3α-(ブチルカルバモイルオキシ)-5-[2-(ジメチルアミノ)エチル]-8-メトキシ-2,3-ジヒドロ-1,5-ベンゾチアゼピン-4(5H)-オン
  • (2R,3R)-5-[2-(ジメチルアミノ)エチル]-8-メトキシ-2-(4-メトキシフェニル)-4-オキソ-2,3,4,5-テトラヒドロ-1,5-ベンゾチアゼピン-3-イル N-ブチルカルバマート
  • (2R,3R)-5-[2-(dimethylamino)ethyl]-8-methoxy-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl N-butylcarbamate
Other name (1)：
  • (2R)-2α-(4-Methoxyphenyl)-3α-(butylcarbamoyloxy)-5-[2-(dimethylamino)ethyl]-8-methoxy-2,3-dihydro-1,5-benzothiazepin-4(5H)-one
Thsaurus map：
Thesaurus Map

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