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N-{2-[3'-Benzoyl-4'-(p-tolylacetylamino)phenylcarbamoyl]ethyl}-3-[(biphenyl-4"-yl)-acrylamide
SpectraBase Compound ID 1czDkB1eN9j
InChI InChI=1S/C40H35N3O4/c1-28-12-14-30(15-13-28)26-39(46)43-36-22-21-34(27-35(36)40(47)33-10-6-3-7-11-33)42-38(45)24-25-41-37(44)23-18-29-16-19-32(20-17-29)31-8-4-2-5-9-31/h2-23,27H,24-26H2,1H3,(H,41,44)(H,42,45)(H,43,46)/b23-18+
InChIKey MPLBXLBXISNYOC-PTGBLXJZSA-N
Mol Weight 621.7 g/mol
Molecular Formula C40H35N3O4
Exact Mass 621.262757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 83VHeyfewM7
Name N-{2-[3'-Benzoyl-4'-(p-tolylacetylamino)phenylcarbamoyl]ethyl}-3-[(biphenyl-4"-yl)-acrylamide
Alternate Name(s) N-[3-benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-[[(E)-1-oxo-3-(4-phenylphenyl)prop-2-enyl]amino]propanamide N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]propanamide N-[3-benzoyl-4-[[2-(p-tolyl)acetyl]amino]phenyl]-3-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]propanamide N-[4-[2-(4-methylphenyl)ethanoylamino]-3-(phenylcarbonyl)phenyl]-3-[[(E)-3-(4-phenylphenyl)prop-2-enoyl]amino]propanamide
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Formula C40H35N3O4
InChI InChI=1S/C40H35N3O4/c1-28-12-14-30(15-13-28)26-39(46)43-36-22-21-34(27-35(36)40(47)33-10-6-3-7-11-33)42-38(45)24-25-41-37(44)23-18-29-16-19-32(20-17-29)31-8-4-2-5-9-31/h2-23,27H,24-26H2,1H3,(H,41,44)(H,42,45)(H,43,46)/b23-18+
InChIKey MPLBXLBXISNYOC-PTGBLXJZSA-N
Molecular Weight 621.737 g/mol
SMILES N(c1c(cc(NC(CCNC(\C=C\c2ccc(cc2)-c2ccccc2)=O)=O)cc1)C(=O)c1ccccc1)C(=O)Cc1ccc(cc1)C
SPLASH splash10-07r0-0191000000-237511a49d42e18079f8
Source of Spectrum D9-336-248-4
Wiley ID 1551069