Chem
J-GLOBAL ID:200907051387750030   Nikkaji number:J1.030.680I

(E)-3-(4-Methylcarbamoylphenyl)-N-[2-[methyl[2,4-dichloro-3-[(2-methylbenzoxazole-4-yl)oxymethyl]phenyl]amino]-2-oxoethyl]acrylamide

(E)-3-(4-メチルカルバモイルフェニル)-N-[2-[メチル[2,4-ジクロロ-3-[(2-メチルベンゾオキサゾール-4-イル)オキシメチル]フェニル]アミノ]-2-オキソエチル]アクリルアミド
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: C29H26Cl2N4O5
Molecular formula furigana: C29-H26-CL2-N4-O5
Molecular weight: 581.450
InChI: InChI=1S/C29H26Cl2N4O5/c1-17-34-28-23(5-4-6-24(28)40-17)39-16-20-21(30)12-13-22(27(20)31)35(3)26(37)15-33-25(36)14-9-18-7-10-19(11-8-18)29(38)32-2/h4-14H,15-16H2,1-3H3,(H,32,38)(H,33,36)/b14-9+
InChI key: YGCJXJRNIIUTAT-NTEUORMPSA-N
SMILES: CNC(=O)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccc4oc(C)nc34)c2Cl)cc1
Systematic name  (3):
  • (E)-3-(4-メチルカルバモイルフェニル)-N-[2-[メチル[2,4-ジクロロ-3-[(2-メチルベンゾオキサゾール-4-イル)オキシメチル]フェニル]アミノ]-2-オキソエチル]アクリルアミド
  • 4-[(1E)-2-({[(2,4-ジクロロ-3-{[(2-メチル-1,3-ベンゾオキサゾール-4-イル)オキシ]メチル}フェニル)(メチル)カルバモイル]メチル}カルバモイル)エタ-1-エン-1-イル]-N-メチルベンズアミド
  • 4-[(1E)-2-({[(2,4-dichloro-3-{[(2-methyl-1,3-benzoxazol-4-yl)oxy]methyl}phenyl)(methyl)carbamoyl]methyl}carbamoyl)eth-1-en-1-yl]-N-methylbenzamide
Other name (1):
  • (E)-3-(4-Methylcarbamoylphenyl)-N-[2-[methyl[2,4-dichloro-3-[(2-methylbenzoxazole-4-yl)oxymethyl]phenyl]amino]-2-oxoethyl]acrylamide
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