Chem
J-GLOBAL ID：200907000298825600   Nikkaji number：J2.365.284F

(6R)-1-(N-Acetyl-D-phenylalanyl)-3-(4-methylphenyl)-6β-(1H-indole-3-yl)-1,4,5,6-tetrahydro-1,2,4-triazine-5-one

(6R)-1-(N-アセチル-D-フェニルアラニル)-3-(4-メチルフェニル)-6β-(1H-インドール-3-イル)-1,4,5,6-テトラヒドロ-1,2,4-トリアジン-5-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： C29H27N5O3
Molecular formula furigana： C29-H27-N5-O3
Molecular weight： 493.567
InChI： InChI=1S/C29H27N5O3/c1-18-12-14-21(15-13-18)27-32-28(36)26(23-17-30-24-11-7-6-10-22(23)24)34(33-27)29(37)25(31-19(2)35)16-20-8-4-3-5-9-20/h3-15,17,25-26,30H,16H2,1-2H3,(H,31,35)(H,32,33,36)/t25-,26-/m1/s1
InChI key： LDTOADFFNDFLDK-CLJLJLNGSA-N
SMILES： CC(=O)N[C@H](Cc1ccccc1)C(=O)N1N=C(NC(=O)[C@H]1c1c[nH]c2ccccc12)c1ccc(C)cc1
Systematic name  (3)：
  • (6R)-1-(N-アセチル-D-フェニルアラニル)-3-(4-メチルフェニル)-6β-(1H-インドール-3-イル)-1,4,5,6-テトラヒドロ-1,2,4-トリアジン-5-オン
  • N-[(2R)-1-[(6R)-6-(1H-インドール-3-イル)-3-(4-メチルフェニル)-5-オキソ-1,4,5,6-テトラヒドロ-1,2,4-トリアジン-1-イル]-1-オキソ-3-フェニルプロパン-2-イル]アセトアミド
  • N-[(2R)-1-[(6R)-6-(1H-indol-3-yl)-3-(4-methylphenyl)-5-oxo-1,4,5,6-tetrahydro-1,2,4-triazin-1-yl]-1-oxo-3-phenylpropan-2-yl]acetamide
Other name (1)：
  • (6R)-1-(N-Acetyl-D-phenylalanyl)-3-(4-methylphenyl)-6β-(1H-indole-3-yl)-1,4,5,6-tetrahydro-1,2,4-triazine-5-one
Thsaurus map：
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