Chem
J-GLOBAL ID：200907051779262255   Nikkaji number：J2.365.263C

N-[2-[(2,4-Dinitrophenyl)thio]-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-3(4H)-yl]methanesulfonamide

N-[2-[(2,4-ジニトロフェニル)チオ]-4-オキソ-5,6,7,8-テトラヒドロ[1]ベンゾチエノ[2,3-d]ピリミジン-3(4H)-イル]メタンスルホンアミド
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： C17H15N3[N+]2O5[O-]2S3
Molecular formula furigana： C17-H15-N5-O7-S3
Molecular weight： 497.520
InChI： InChI=1S/C17H15N5O7S3/c1-32(28,29)19-20-16(23)14-10-4-2-3-5-12(10)30-15(14)18-17(20)31-13-7-6-9(21(24)25)8-11(13)22(26)27/h6-8,19H,2-5H2,1H3
InChI key： RYTBHXUMBBTRET-UHFFFAOYSA-N
SMILES： CS(=O)(=O)Nn1c(Sc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])nc2sc3CCCCc3c2c1=O
Systematic name  (3)：
  • N-[2-[(2,4-ジニトロフェニル)チオ]-4-オキソ-5,6,7,8-テトラヒドロ[1]ベンゾチエノ[2,3-d]ピリミジン-3(4H)-イル]メタンスルホンアミド
  • N-{5-[(2,4-ジニトロフェニル)スルファニル]-3-オキソ-8-チア-4,6-ジアザトリシクロ[7.4.0.02,7]トリデカ-1(9),2(7),5-トリエン-4-イル}メタンスルホンアミド
  • N-{5-[(2,4-dinitrophenyl)sulfanyl]-3-oxo-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),5-trien-4-yl}methanesulfonamide
Other name (1)：
  • N-[2-[(2,4-Dinitrophenyl)thio]-4-oxo-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine-3(4H)-yl]methanesulfonamide
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