Vitas-M small molecule compound

ethyl 2-({[3-(acetyloxy)phenyl]carbonyl}amino)-4-(4-bromophenyl)thiophene-3-carboxylate

Catalog ID
STK744587
SMILES CCOC(=O)c1c(scc1c1ccc(cc1)Br)NC(=O)c1cccc(c1)OC(=O)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H18BrNO5S MW 488.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrNO5S/c1-3-28-22(27)19-18(14-7-9-16(23)10-8-14)12-30-21(19)24-20(26)15-5-4-6-17(11-15)29-13(2)25/h4-12H,3H2,1-2H3,(H,24,26)
InChIKey
ZIHCMBDONWYKME-UHFFFAOYSA-N
Synonyms
380643-84-5
380643845
CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Br)NC(=O)C3=CC(=CC=C3)OC(=O)C
ethyl2(((3(acetyloxy)phenyl)carbonyl)amino)4(4bromophenyl)thiophene3carboxylate
ETHYL2((3(ACETYLOXY)BENZOYL)AMINO)4(4BROMOPHENYL)3THIOPHENECARBOXYLATE
ETHYL2((3(ACETYLOXY)BENZOYL)AMINO)4(4BROMOPHENYL)THIOPHENE3CARBOXYLATE
ETHYL2((3ACETYLOXYBENZOYL)AMINO)4(4BROMOPHENYL)THIOPHENE3CARBOXYLATE
ethyl2(3acetoxybenzamido)4(4bromophenyl)thiophene3carboxylate
InChI=1SC22H18BrNO5Sc132822(27)1918(147916(23)10814)123021(19)2420(26)1554617(1115)2913(2)25h412H3H212H3(H2426)
MFCD02942813
ZINC000002060205
ZINC02060205
ZINC2060205

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.