Ethyl 2-[[(6-bromo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-3-thiophenecarboxylate

CAS Registry Number®

438218-21-4
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CAS Name

Ethyl 2-[[(6-bromo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-3-thiophenecarboxylate

Molecular Formula

C26H22BrNO5S

Molecular Mass

540.43

Cite this Page

Ethyl 2-[[(6-bromo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-3-thiophenecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=438218-21-4 (retrieved 2024-09-06) (CAS RN: 438218-21-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C26H22BrNO5S/c1-5-32-26(31)22-21(18-10-13(2)6-7-14(18)3)15(4)34-24(22)28-23(29)19-12-16-11-17(27)8-9-20(16)33-25(19)30/h6-12H,5H2,1-4H3,(H,28,29)

InChIKey

InChIKey=WFIWLBYDGAETHR-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C=1C(=C(C)SC1NC(=O)C2=CC=3C(OC2=O)=CC=C(Br)C3)C4=C(C)C=CC(C)=C4

Canonical SMILES

O=C1OC=2C=CC(Br)=CC2C=C1C(=O)NC=3SC(=C(C4=CC(=CC=C4C)C)C3C(=O)OCC)C

Other Names for this Substance

  • 3-Thiophenecarboxylic acid, 2-[[(6-bromo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-, ethyl ester
  • Ethyl 2-[[(6-bromo-2-oxo-2H-1-benzopyran-3-yl)carbonyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-3-thiophenecarboxylate