Chem
J-GLOBAL ID：200907013377073686
Nikkaji number：J1.503.756C
(2β,6β,10-anti)-3,5-Dioxo-4-phenyl-1α,7α,8,9,10-pentamethyl-4-azatricyclo[5.2.1.02,6]decane-8-ene-10-dithiocarboxylic acid methyl ester
(2β,6β,10-anti)-3,5-ジオキソ-4-フェニル-1α,7α,8,9,10-ペンタメチル-4-アザトリシクロ[5.2.1.02,6]デカン-8-エン-10-ジチオカルボン酸メチル
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
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
Molecular formula： C22H25NO2S2
Molecular formula furigana： C22-H25-N-O2-S2
Molecular weight： 399.570
InChI：
InChI=1S/C22H25NO2S2/c1-12-13(2)21(4)16-15(20(12,3)22(21,5)19(26)27-6)17(24)23(18(16)25)14-10-8-7-9-11-14/h7-11,15-16H,1-6H3/t15-,16+,20+,21-,22?
InChI key：
RQAFKHBKYHVBIR-YVZPGZCDSA-N
SMILES：
CSC(=S)C1(C)[C@]2(C)[C@@H]3[C@@H](C(=O)N(C3=O)c3ccccc3)[C@@]1(C)C(=C2C)C
Systematic name (1)：
- (2β,6β,10-anti)-3,5-ジオキソ-4-フェニル-1α,7α,8,9,10-ペンタメチル-4-アザトリシクロ[5.2.1.02,6]デカン-8-エン-10-ジチオカルボン酸メチル
- (2β,6β,10-anti)-3,5-Dioxo-4-phenyl-1α,7α,8,9,10-pentamethyl-4-azatricyclo[5.2.1.02,6]decane-8-ene-10-dithiocarboxylic acid methyl ester
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