Chem
J-GLOBAL ID:200907076138151626
Nikkaji number:J2.745.141A
(2S)-N-(3-Chlorobenzyl)-1-[(2R)-2-amino-3-cyclohexylpropionyl]pyrrolidine-2-carboxamide
(2S)-N-(3-クロロベンジル)-1-[(2R)-2-アミノ-3-シクロヘキシルプロピオニル]ピロリジン-2-カルボアミド
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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:
C21 H30 ClN3 O2
Molecular formula furigana:
C21-H30-CL-N3-O2
Molecular weight:
391.940
InChI:
InChI=1S/C21H30ClN3O2/c22-17-9-4-8-16(12-17)14-24-20(26)19-10-5-11-25(19)21(27)18(23)13-15-6-2-1-3-7-15/h4,8-9,12,15,18-19H,1-3,5-7,10-11,13-14,23H2,(H,24,26)/t18-,19+/m1/s1
InChI key:
JGFCNVHEEMBVJG-MOPGFXCFSA-N
SMILES:
N[C@H](CC1CCCCC1)C(=O)N1CCC[C@H]1C(=O)NCc1cccc(Cl)c1
Systematic name (3):
(2S)-N-(3-クロロベンジル)-1-[(2R)-2-アミノ-3-シクロヘキシルプロピオニル]ピロリジン-2-カルボアミド
(2S)-1-[(2R)-2-アミノ-3-シクロヘキシルプロパノイル]-N-[(3-クロロフェニル)メチル]ピロリジン-2-カルボキサミド
(2S)-1-[(2R)-2-amino-3-cyclohexylpropanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide
Other name (1):
(2S)-N-(3-Chlorobenzyl)-1-[(2R)-2-amino-3-cyclohexylpropionyl]pyrrolidine-2-carboxamide
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