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N-[3-Benzoyl-4-(4-tolylacetylamino)phenyl]-3-[4-(4-methylphenyl)-2-thienyl]acrylic acid amide
SpectraBase Compound ID Foh88Qmpp8H
InChI InChI=1S/C36H30N2O3S/c1-24-8-12-26(13-9-24)20-35(40)38-33-18-16-30(22-32(33)36(41)28-6-4-3-5-7-28)37-34(39)19-17-31-21-29(23-42-31)27-14-10-25(2)11-15-27/h3-19,21-23H,20H2,1-2H3,(H,37,39)(H,38,40)/b19-17+
InChIKey XGNDPJZDRYHZIE-HTXNQAPBSA-N
Mol Weight 570.7 g/mol
Molecular Formula C36H30N2O3S
Exact Mass 570.197714 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1U328WrZRhh
Name N-[3-Benzoyl-4-(4-tolylacetylamino)phenyl]-3-[4-(4-methylphenyl)-2-thienyl]acrylic acid amide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C36H30N2O3S
InChI InChI=1S/C36H30N2O3S/c1-24-8-12-26(13-9-24)20-35(40)38-33-18-16-30(22-32(33)36(41)28-6-4-3-5-7-28)37-34(39)19-17-31-21-29(23-42-31)27-14-10-25(2)11-15-27/h3-19,21-23H,20H2,1-2H3,(H,37,39)(H,38,40)/b19-17+
InChIKey XGNDPJZDRYHZIE-HTXNQAPBSA-N
Literature Reference DOI 10.1002/ardp.200400886
Molecular Weight 570.707 g/mol
SMILES N(C(\C=C\c1cc(cs1)-c1ccc(cc1)C)=O)c1ccc(c(c1)C(=O)c1ccccc1)NC(=O)Cc1ccc(cc1)C
SPLASH splash10-0a4l-9000000000-6f162b04b740d77347b9
Source of Spectrum APC-338-15-11b
Synonyms (E)-N-(3-benzoyl-4-(2-(p-tolyl)acetamido)phenyl)-3-(4-(p-tolyl)thiophen-2-yl)acrylamide (E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)-1-oxoethyl]amino]phenyl]-3-[4-(4-methylphenyl)-2-thiophenyl]-2-propenamide (E)-N-[3-benzoyl-4-[[2-(4-methylphenyl)acetyl]amino]phenyl]-3-[4-(4-methylphenyl)thiophen-2-yl]prop-2-enamide (E)-N-[3-benzoyl-4-[[2-(p-tolyl)acetyl]amino]phenyl]-3-[4-(p-tolyl)-2-thienyl]prop-2-enamide (E)-N-[4-[2-(4-methylphenyl)ethanoylamino]-3-(phenylcarbonyl)phenyl]-3-[4-(4-methylphenyl)thiophen-2-yl]prop-2-enamide
Wiley ID 1770883