Chem
J-GLOBAL ID：200907000611836139   Nikkaji number：J366.661A

(6S)-4-(2-Chlorophenyl)-2-[2-[4-(2-methylpropyl)phenyl]ethyl]-6,9-dimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine

(6S)-4-(2-クロロフェニル)-2-[2-[4-(2-メチルプロピル)フェニル]エチル]-6,9-ジメチル-6H-チエノ[3,2-f][1,2,4]トリアゾロ[4,3-a][1,4]ジアゼピン
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： C28H29ClN4S
Molecular formula furigana： C28-H29-CL-N4-S
Molecular weight： 489.080
InChI： InChI=1S/C28H29ClN4S/c1-17(2)15-21-11-9-20(10-12-21)13-14-22-16-24-26(23-7-5-6-8-25(23)29)30-18(3)27-32-31-19(4)33(27)28(24)34-22/h5-12,16-18H,13-15H2,1-4H3/t18-/m0/s1
InChI key： RMSWMRJVUJSDGN-SFHVURJKSA-N
SMILES： CC(C)Cc1ccc(CCc2cc3c(s2)n2c(C)nnc2[C@H](C)N=C3c2ccccc2Cl)cc1
Systematic name  (3)：
  • (6S)-4-(2-クロロフェニル)-2-[2-[4-(2-メチルプロピル)フェニル]エチル]-6,9-ジメチル-6H-チエノ[3,2-f][1,2,4]トリアゾロ[4,3-a][1,4]ジアゼピン
  • (9S)-7-(2-クロロフェニル)-9,13-ジメチル-4-{2-[4-(2-メチルプロピル)フェニル]エチル}-3-チア-1,8,11,12-テトラアザトリシクロ[8.3.0.02,6]トリデカ-2(6),4,7,10,12-ペンタエン
  • (9S)-7-(2-chlorophenyl)-9,13-dimethyl-4-{2-[4-(2-methylpropyl)phenyl]ethyl}-3-thia-1,8,11,12-tetraazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaene
Other name (1)：
  • (6S)-4-(2-Chlorophenyl)-2-[2-[4-(2-methylpropyl)phenyl]ethyl]-6,9-dimethyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
Thsaurus map：
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