Chem
J-GLOBAL ID：200907054359243203   Nikkaji number：J752.544C

2-(Benzylthio)-4-aminopyrimido[4,5-d]pyridazine-5,8(6H,7H)-dione

2-(ベンジルチオ)-4-アミノピリミド[4,5-d]ピリダジン-5,8(6H,7H)-ジオン
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： C13H11N5O2S
Molecular formula furigana： C13-H11-N5-O2-S
Molecular weight： 301.320
InChI： InChI=1S/C13H11N5O2S/c14-10-8-9(12(20)18-17-11(8)19)15-13(16-10)21-6-7-4-2-1-3-5-7/h1-5H,6H2,(H,17,19)(H,18,20)(H2,14,15,16)
InChI key： VXTPGTHPJGQXHB-UHFFFAOYSA-N
SMILES： Nc1nc(SCc2ccccc2)nc2c1c(=O)[nH][nH]c2=O
Systematic name  (4)：
  • 2-(ベンジルチオ)-4-アミノピリミド[4,5-d]ピリダジン-5,8(6H,7H)-ジオン
  • 2-(ベンジルチオ)-4-アミノ-6,7-ジヒドロピリミド[4,5-d]ピリダジン-5,8-ジオン
  • 4-アミノ-2-(ベンジルスルファニル)-5H,6H,7H,8H-ピリミド[4,5-d]ピリダジン-5,8-ジオン
  • 4-amino-2-(benzylsulfanyl)-5H,6H,7H,8H-pyrimido[4,5-d]pyridazine-5,8-dione
Other name (2)：
  • 2-(Benzylthio)-4-aminopyrimido[4,5-d]pyridazine-5,8(6H,7H)-dione
  • 2-(Benzylthio)-4-amino-6,7-dihydropyrimido[4,5-d]pyridazine-5,8-dione
Thsaurus map：
Thesaurus Map

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