Chem
J-GLOBAL ID：201407079057015158   Nikkaji number：J3.318.409C

(2R)-4-Tosyl-8-methyl-2,6-bis(phenylsulfonyl)-4-azabicyclo[5.3.0]deca-1(10),6-diene-9-one

(2R)-4-トシル-8-メチル-2,6-ビス(フェニルスルホニル)-4-アザビシクロ[5.3.0]デカ-1(10),6-ジエン-9-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： C29H27NO7S3
Molecular formula furigana： C29-H27-N-O7-S3
Molecular weight： 597.720
InChI： InChI=1S/C29H27NO7S3/c1-20-13-15-24(16-14-20)40(36,37)30-18-27(38(32,33)22-9-5-3-6-10-22)25-17-26(31)21(2)29(25)28(19-30)39(34,35)23-11-7-4-8-12-23/h3-17,21,27H,18-19H2,1-2H3/t21?,27-/m0/s1
InChI key： NCYCMWKZWFKYMT-YQAGWJQESA-N
SMILES： CC1C(=O)C=C2[C@H](CN(CC(=C12)S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccc(C)cc1)S(=O)(=O)c1ccccc1
Systematic name  (3)：
  • (2R)-4-トシル-8-メチル-2,6-ビス(フェニルスルホニル)-4-アザビシクロ[5.3.0]デカ-1(10),6-ジエン-9-オン
  • (1R)-1,5-ビス(ベンゼンスルホニル)-6-メチル-3-(4-メチルベンゼンスルホニル)-1H,2H,3H,4H,6H,7H-シクロペンタ[d]アゼピン-7-オン
  • (1R)-1,5-bis(benzenesulfonyl)-6-methyl-3-(4-methylbenzenesulfonyl)-1H,2H,3H,4H,6H,7H-cyclopenta[d]azepin-7-one
Other name (1)：
  • (2R)-4-Tosyl-8-methyl-2,6-bis(phenylsulfonyl)-4-azabicyclo[5.3.0]deca-1(10),6-diene-9-one
Thsaurus map：
Thesaurus Map

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