Chem
J-GLOBAL ID：200907069426262479   Nikkaji number：J2.059.057B

2-[(αR)-α-Hydroxy-4-[7-[4-(2-butoxyethoxy)phenyl]-1,1-dioxo-2,3-dihydro-1-thia(VI)-1-benzothiepin-4-ylcarbonylamino]benzyl]pyridine 1-oxide

2-[(R)-(4-{7-[4-(2-ブトキシエトキシ)フェニル]-1,1-ジオキソ-2,3-ジヒドロ-1λ6-ベンゾチエピン-4-アミド}フェニル)(ヒドロキシ)メチル]ピリジン-1-イウム-1-オラート
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： C35H36N[N+]O6[O-]S
Molecular formula furigana： C35-H36-N2-O7-S
Molecular weight： 628.740
InChI： InChI=1S/C35H36N2O7S/c1-2-3-19-43-20-21-44-31-14-9-25(10-15-31)27-11-16-33-29(23-27)24-28(17-22-45(33,41)42)35(39)36-30-12-7-26(8-13-30)34(38)32-6-4-5-18-37(32)40/h4-16,18,23-24,34,38H,2-3,17,19-22H2,1H3,(H,36,39)/t34-/m1/s1
InChI key： VZEVJPWKSMABKE-UUWRZZSWSA-N
SMILES： CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCS2(=O)=O)C(=O)Nc1ccc(cc1)[C@@H](O)c1cccc[n+]1[O-]
Systematic name  (3)：
  • 2-[(αR)-α-ヒドロキシ-4-[7-[4-(2-ブトキシエトキシ)フェニル]-1,1-ジオキソ-2,3-ジヒドロ-1-チア(VI)-1-ベンゾチエピン-4-イルカルボニルアミノ]ベンジル]ピリジン1-オキシド
  • 2-[(R)-(4-{7-[4-(2-ブトキシエトキシ)フェニル]-1,1-ジオキソ-2,3-ジヒドロ-1λ6-ベンゾチエピン-4-アミド}フェニル)(ヒドロキシ)メチル]ピリジン-1-イウム-1-オラート
  • 2-[(R)-(4-{7-[4-(2-butoxyethoxy)phenyl]-1,1-dioxo-2,3-dihydro-1λ6-benzothiepine-4-amido}phenyl)(hydroxy)methyl]pyridin-1-ium-1-olate
Other name (1)：
  • 2-[(αR)-α-Hydroxy-4-[7-[4-(2-butoxyethoxy)phenyl]-1,1-dioxo-2,3-dihydro-1-thia(VI)-1-benzothiepin-4-ylcarbonylamino]benzyl]pyridine 1-oxide
Thsaurus map：
Thesaurus Map

Return to Previous Page

TOP

BOTTOM