Vitas-M small molecule compound

propyl 4-(3-bromophenyl)-2-{[(4-methoxyphenyl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK962469
SMILES CCCOC(=O)c1c(scc1c1cccc(c1)Br)NC(=O)c1ccc(cc1)OC

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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 C22H20BrNO4S MW 474.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrNO4S/c1-3-11-28-22(26)19-18(15-5-4-6-16(23)12-15)13-29-21(19)24-20(25)14-7-9-17(27-2)10-8-14/h4-10,12-13H,3,11H2,1-2H3,(H,24,25)
InChIKey
DZJKTHSDCXURAZ-UHFFFAOYSA-N
Synonyms

CCCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)Br)NC(=O)C3=CC=C(C=C3)OC
InChI=1SC22H20BrNO4Sc13112822(26)1918(1554616(23)1215)132921(19)2420(25)147917(272)10814h4101213H311H212H3(H2425)
MFCD03470029
PROPYL4(3BROMOPHENYL)2(((4METHOXYPHENYL)CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
PROPYL4(3BROMOPHENYL)2((4METHOXYBENZOYL)AMINO)THIOPHENE3CARBOXYLATE
PROPYL4(3BROMOPHENYL)2((4METHOXYPHENYL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
ZINC000002762964
ZINC02762964
ZINC2762964

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Available files

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