Chem
J-GLOBAL ID:200907018693851307   Nikkaji number:J1.356.602J

(3R)-1-[[(1S,4R)-4,7,7-Trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-yl]carbonyl]-2′-methylthiospiro[3H-indole-3,5′(4′H)-thiazole]-2(1H)-one

(3R)-1-[[(1S,4R)-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-イル]カルボニル]-2′-メチルチオスピロ[3H-インドール-3,5′(4′H)-チアゾール]-2(1H)-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: C21H22N2O4S2
Molecular formula furigana: C21-H22-N2-O4-S2
Molecular weight: 430.540
InChI: InChI=1S/C21H22N2O4S2/c1-18(2)19(3)9-10-21(18,27-16(19)26)15(25)23-13-8-6-5-7-12(13)20(14(23)24)11-22-17(28-4)29-20/h5-8H,9-11H2,1-4H3/t19-,20-,21+/m0/s1
InChI key: SHYMUJCIPQMRMM-PCCBWWKXSA-N
SMILES: CSC1=NC[C@@]2(S1)C(=O)N(C(=O)[C@@]13CC[C@@](C)(C(=O)O1)C3(C)C)c1ccccc21
Systematic name  (3):
  • (3R)-1-[[(1S,4R)-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-イル]カルボニル]-2′-メチルチオスピロ[3H-インドール-3,5′(4′H)-チアゾール]-2(1H)-オン
  • (3R)-5'-(メチルスルファニル)-1-[(1S,4R)-4,7,7-トリメチル-3-オキソ-2-オキサビシクロ[2.2.1]ヘプタン-1-カルボニル]-1,2-ジヒドロ-3'H-スピロ[インドール-3,2'-[1,4]チアゾール]-2-オン
  • (3R)-5'-(methylsulfanyl)-1-[(1S,4R)-4,7,7-trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-carbonyl]-1,2-dihydro-3'H-spiro[indole-3,2'-[1,4]thiazol]-2-one
Other name (1):
  • (3R)-1-[[(1S,4R)-4,7,7-Trimethyl-3-oxo-2-oxabicyclo[2.2.1]heptane-1-yl]carbonyl]-2′-methylthiospiro[3H-indole-3,5′(4′H)-thiazole]-2(1H)-one
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