Chem
J-GLOBAL ID：200907001856603799   Nikkaji number：J456.780C

N-tert-Butoxycarbonyl-L-Val-N-[(2,3-dihydro-1H-inden)-2-yl]-Gly-(1-isopropyl-3,3,3-trifluoro-2-oxopropyl)NH2

N-tert-ブトキシカルボニル-L-Val-N-[(2,3-ジヒドロ-1H-インデン)-2-イル]-Gly-(1-イソプロピル-3,3,3-トリフルオロ-2-オキソプロピル)NH2
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： C27H38F3N3O5
Molecular formula furigana： C27-H38-F3-N3-O5
Molecular weight： 541.612
InChI： InChI=1S/C27H38F3N3O5/c1-15(2)21(23(35)27(28,29)30)31-20(34)14-33(19-12-17-10-8-9-11-18(17)13-19)24(36)22(16(3)4)32-25(37)38-26(5,6)7/h8-11,15-16,19,21-22H,12-14H2,1-7H3,(H,31,34)(H,32,37)/t21?,22-/m0/s1
InChI key： HZURUQUHOXPUDS-KEKNWZKVSA-N
SMILES： CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N(CC(=O)NC(C(C)C)C(=O)C(F)(F)F)C1Cc2ccccc2C1
Systematic name  (3)：
  • N-tert-ブトキシカルボニル-L-Val-N-[(2,3-ジヒドロ-1H-インデン)-2-イル]-Gly-(1-イソプロピル-3,3,3-トリフルオロ-2-オキソプロピル)NH2
  • tert-ブチル N-[(1S)-1-[(2,3-ジヒドロ-1H-インデン-2-イル)({[(1,1,1-トリフルオロ-4-メチル-2-オキソペンタン-3-イル)カルバモイル]メチル})カルバモイル]-2-メチルプロピル]カルバマート
  • tert-butyl N-[(1S)-1-[(2,3-dihydro-1H-inden-2-yl)({[(1,1,1-trifluoro-4-methyl-2-oxopentan-3-yl)carbamoyl]methyl})carbamoyl]-2-methylpropyl]carbamate
Other name (1)：
  • N-tert-Butoxycarbonyl-L-Val-N-[(2,3-dihydro-1H-inden)-2-yl]-Gly-(1-isopropyl-3,3,3-trifluoro-2-oxopropyl)NH2
Thsaurus map：
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