Chem
J-GLOBAL ID:200907046788423047   Nikkaji number:J2.531.195G

6-Bromo-2β-methyl-4β-[(4-methylphenyl)thio]-3,4-dihydro-2H-1-benzothiopyran

6-ブロモ-2β-メチル-4β-[(4-メチルフェニル)チオ]-3,4-ジヒドロ-2H-1-ベンゾチオピラン
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: C17H17BrS2
Molecular formula furigana: C17-H17-BR-S2
Molecular weight: 365.350
InChI: InChI=1S/C17H17BrS2/c1-11-3-6-14(7-4-11)20-17-9-12(2)19-16-8-5-13(18)10-15(16)17/h3-8,10,12,17H,9H2,1-2H3/t12-,17+/m0/s1
InChI key: RYLIWDHMJRTKFB-YVEFUNNKSA-N
SMILES: C[C@H]1C[C@@H](Sc2ccc(C)cc2)c2cc(Br)ccc2S1
Systematic name  (3):
  • 6-ブロモ-2β-メチル-4β-[(4-メチルフェニル)チオ]-3,4-ジヒドロ-2H-1-ベンゾチオピラン
  • (2S,4R)-6-ブロモ-2-メチル-4-[(4-メチルフェニル)スルファニル]-3,4-ジヒドロ-2H-1-ベンゾチオピラン
  • (2S,4R)-6-bromo-2-methyl-4-[(4-methylphenyl)sulfanyl]-3,4-dihydro-2H-1-benzothiopyran
Other name (1):
  • 6-Bromo-2β-methyl-4β-[(4-methylphenyl)thio]-3,4-dihydro-2H-1-benzothiopyran
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