Chemical Compound

2-Bromoacetylamino-3-(2-chlorobenzoyl)-5-(2-carbomethoxyethyl)thiophene

CAS Registry Number100827-79-0
2-Bromoacetylamino-3-(2-chlorobenzoyl)-5-(2-carbomethoxyethyl)thiophene chemical structure
Primary record

2-Bromoacetylamino-3-(2-chlorobenzoyl)-5-(2-carbomethoxyethyl)thiophene

CAS
100827-79-0
PubChem CID
13670765
SMILES
COC(=O)CCC1=CC(=C(S1)NC(=O)CBr)C(=O)C2=CC=CC=C2Cl
Molecular Formula
C17H15BrClNO4S
Molecular Weight
444.734
Exact Mass
442.9594
InChI
InChI=1S/C17H15BrClNO4S/c1-24-15(22)7-6-10-8-12(17(25-10)20-14(21)9-18)16(23)11-4-2-3-5-13(11)19/h2-5,8H,6-7,9H2,1H3,(H,20,21)
InChIKey
JLVIHXWHESHBSS-UHFFFAOYSA-N
LogP
4.0715
TPSA
72.47

Names and synonyms

  • 2-Bromoacetylamino-3-(2-chlorobenzoyl)-5-(2-carbomethoxyethyl)thiophene
  • 100827-79-0
  • SCHEMBL9661377
  • JLVIHXWHESHBSS-UHFFFAOYSA-N
  • 5-Bromo-2-bromoacetyl-1-benzofuran
  • ZINC34121000
  • AKOS025394057
  • DB-313765
  • RT-007499
  • FT-0663623
  • methyl 3-[5-[(2-bromoacetyl)amino]-4-(2-chlorobenzoyl)thiophen-2-yl]propanoate
  • 2-Thiophenepropanoic acid, 5-[(2-bromoacetyl)amino]-4-(2-chlorobenzoyl)-, methyl ester
  • 5-[(2-Bromoacetyl)amino]-4-(2-chlorobenzoyl)-2-thiophenepropanoic Acid Methyl Ester
  • 5-[(Bromoacetyl)amino]-4-(2-chlorobenzoyl)-2-thiophenepropanoic Acid Methyl Ester
  • Methyl 3-{5-[(bromoacetyl)amino]-4-(2-chlorobenzoyl)-2-thienyl}pr opanoate
  • 5-[(2-Bromoacetyl)amino]-4-(2-chlorobenzoyl)-2-thiophenepropanoic Acid Methyl Ester; 5-[(Bromoacetyl)amino]-4-(2-chlorobenzoyl)-2-thiophenepropanoic Acid Methyl Ester;