Chem
J-GLOBAL ID：200907079823125068
Nikkaji number：J2.311.552B
N-(29-Mercapto-3,6,12,15-tetraoxa-9-azanonacosane-1-yl)-4-[3-(trifluoromethyl)-3H-diazirine-3-yl]benzamide
N-(29-メルカプト-3,6,12,15-テトラオキサ-9-アザノナコサン-1-イル)-4-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]ベンズアミド
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
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
Molecular formula： C33H55F3N4O5S
Molecular formula furigana： C33-H55-F3-N4-O5-S
Molecular weight： 676.880
InChI：
InChI=1S/C33H55F3N4O5S/c34-33(35,36)32(39-40-32)30-15-13-29(14-16-30)31(41)38-19-23-45-27-26-44-22-18-37-17-21-43-25-24-42-20-11-9-7-5-3-1-2-4-6-8-10-12-28-46/h13-16,37,46H,1-12,17-28H2,(H,38,41)
InChI key：
KHNHZJPWSKBHQN-UHFFFAOYSA-N
SMILES：
FC(F)(F)C1(N=N1)c1ccc(cc1)C(=O)NCCOCCOCCNCCOCCOCCCCCCCCCCCCCCS
Systematic name (3)：
- N-(29-メルカプト-3,6,12,15-テトラオキサ-9-アザノナコサン-1-イル)-4-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]ベンズアミド
- N-(29-スルファニル-3,6,12,15-テトラオキサ-9-アザノナコサン-1-イル)-4-[3-(トリフルオロメチル)-3H-ジアジリン-3-イル]ベンズアミド
- N-(29-sulfanyl-3,6,12,15-tetraoxa-9-azanonacosan-1-yl)-4-[3-(trifluoromethyl)-3H-diazirin-3-yl]benzamide
- N-(29-Mercapto-3,6,12,15-tetraoxa-9-azanonacosane-1-yl)-4-[3-(trifluoromethyl)-3H-diazirine-3-yl]benzamide
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