Chem
J-GLOBAL ID:200907020235007585
Nikkaji number:J1.539.997J
N-[1-(2-Pyridinylsulfonyl)-3-oxohexahydro-1H-azepine-4β-yl]-Nα -[(benzofuran-2-yl)carbonyl]-L-leucinamide
N-[1-(2-ピリジニルスルホニル)-3-オキソヘキサヒドロ-1H-アゼピン-4β-イル]-Nα -[(ベンゾフラン-2-イル)カルボニル]-L-ロイシンアミド
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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:
C26 H30 N4 O6 S
Molecular formula furigana:
C26-H30-N4-O6-S
Molecular weight:
526.610
InChI:
InChI=1S/C26H30N4O6S/c1-17(2)14-20(29-26(33)23-15-18-8-3-4-10-22(18)36-23)25(32)28-19-9-7-13-30(16-21(19)31)37(34,35)24-11-5-6-12-27-24/h3-6,8,10-12,15,17,19-20H,7,9,13-14,16H2,1-2H3,(H,28,32)(H,29,33)/t19-,20-/m0/s1
InChI key:
VBPPNJCVXGAZDD-PMACEKPBSA-N
SMILES:
CC(C)C[C@H](NC(=O)c1cc2ccccc2o1)C(=O)N[C@H]1CCCN(CC1=O)S(=O)(=O)c1ccccn1
Systematic name (6):
N-[(S)-2-[[(4S)-1-[(2-ピリジニル)スルホニル]-3-オキソヘキサヒドロ-1H-アゼピン-4-イル]アミノ]-1-(2-メチルプロピル)-2-オキソエチル]ベンゾフラン-2-カルボアミド
N-[(4S)-1-(2-ピリジニルスルホニル)-3-オキソヘキサヒドロ-1H-アゼピン-4β-イル]-N2 -(ベンゾフラン-2-イルカルボニル)-L-ロイシンアミド
N-[1-(2-ピリジニルスルホニル)-3-オキソヘキサヒドロ-1H-アゼピン-4β-イル]-Nα -[(ベンゾフラン-2-イル)カルボニル]-L-ロイシンアミド
N-[(1S)-1-[[(4S)-1-[(2-ピリジル)スルホニル]-3-オキソ-ヘキサヒドロ-1H-アゼピン-4-イル]カルバモイル]-3-メチルブチル]ベンゾフラン-2-カルボアミド
(2S)-2-[(1-ベンゾフラン-2-イル)ホルムアミド]-4-メチル-N-[(4S)-3-オキソ-1-(ピリジン-2-スルホニル)アゼパン-4-イル]ペンタンアミド
(2S)-2-[(1-benzofuran-2-yl)formamido]-4-methyl-N-[(4S)-3-oxo-1-(pyridine-2-sulfonyl)azepan-4-yl]pentanamide
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Other name (4):
N-[(S)-2-[[(4S)-1-[(2-Pyridinyl)sulfonyl]-3-oxohexahydro-1H-azepine-4-yl]amino]-1-(2-methylpropyl)-2-oxoethyl]benzofuran-2-carboxamide
N-[(4S)-1-(2-Pyridinylsulfonyl)-3-oxohexahydro-1H-azepine-4β-yl]-N2 -(benzofuran-2-ylcarbonyl)-L-leucinamide
N-[1-(2-Pyridinylsulfonyl)-3-oxohexahydro-1H-azepine-4β-yl]-Nα -[(benzofuran-2-yl)carbonyl]-L-leucinamide
N-[(1S)-1-[[(4S)-1-[(2-Pyridyl)sulfonyl]-3-oxo-hexahydro-1H-azepine-4-yl]carbamoyl]-3-methylbutyl]benzofuran-2-carboxamide
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