Chem
J-GLOBAL ID：200907031971688338   Nikkaji number：J1.208.632F

3β-Phenyl-3,3aβ,4,5,6,7-hexahydro-5-methyl-7-benzylidene-2H-pyrazolo[4,3-c]pyridine-2-carbothioamide

3β-フェニル-3,3aβ,4,5,6,7-ヘキサヒドロ-5-メチル-7-ベンジリデン-2H-ピラゾロ[4,3-c]ピリジン-2-カルボチオアミド
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： C21H22N4S
Molecular formula furigana： C21-H22-N4-S
Molecular weight： 362.500
InChI： InChI=1S/C21H22N4S/c1-24-13-17(12-15-8-4-2-5-9-15)19-18(14-24)20(25(23-19)21(22)26)16-10-6-3-7-11-16/h2-12,18,20H,13-14H2,1H3,(H2,22,26)/t18-,20+/m1/s1
InChI key： QLNXWTDLBSRVRY-QUCCMNQESA-N
SMILES： CN1C[C@H]2[C@@H](N(N=C2C(=Cc2ccccc2)C1)C(=S)N)c1ccccc1
Systematic name  (3)：
  • 3β-フェニル-3,3aβ,4,5,6,7-ヘキサヒドロ-5-メチル-7-ベンジリデン-2H-ピラゾロ[4,3-c]ピリジン-2-カルボチオアミド
  • (3R,3aS)-5-メチル-3-フェニル-7-(フェニルメチリデン)-2H,3H,3aH,4H,5H,6H,7H-ピラゾロ[4,3-c]ピリジン-2-カルボチオアミド
  • (3R,3aS)-5-methyl-3-phenyl-7-(phenylmethylidene)-2H,3H,3aH,4H,5H,6H,7H-pyrazolo[4,3-c]pyridine-2-carbothioamide
Other name (1)：
  • 3β-Phenyl-3,3aβ,4,5,6,7-hexahydro-5-methyl-7-benzylidene-2H-pyrazolo[4,3-c]pyridine-2-carbothioamide
Thsaurus map：
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