Chem
J-GLOBAL ID:200907048754742642   Nikkaji number:J1.574.816H

(2′S)-2′α-Isopropyl-5′β-methylspiro[4H-1,3-benzodioxin-4,1′-cyclohexane]-2-thione

(2′S)-2′α-イソプロピル-5′β-メチルスピロ[4H-1,3-ベンゾジオキシン-4,1′-シクロヘキサン]-2-チオン
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: C17H22O2S
Molecular formula furigana: C17-H22-O2-S
Molecular weight: 290.420
InChI: InChI=1S/C17H22O2S/c1-11(2)13-9-8-12(3)10-17(13)14-6-4-5-7-15(14)18-16(20)19-17/h4-7,11-13H,8-10H2,1-3H3/t12-,13+,17?/m1/s1
InChI key: CBKXTCZRTJMNBV-LABGONDVSA-N
SMILES: CC(C)[C@@H]1CC[C@@H](C)CC21OC(=S)Oc1ccccc21
Systematic name  (3):
  • (2′S)-2′α-イソプロピル-5′β-メチルスピロ[4H-1,3-ベンゾジオキシン-4,1′-シクロヘキサン]-2-チオン
  • (3'R,6'S)-3'-メチル-6'-(プロパン-2-イル)-2H-スピロ[1,3-ベンゾジオキシン-4,1'-シクロヘキサン]-2-チオン
  • (3'R,6'S)-3'-methyl-6'-(propan-2-yl)-2H-spiro[1,3-benzodioxine-4,1'-cyclohexane]-2-thione
Other name (1):
  • (2′S)-2′α-Isopropyl-5′β-methylspiro[4H-1,3-benzodioxin-4,1′-cyclohexane]-2-thione
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