Vitas-M small molecule compound

ethyl 4-(2-chlorophenyl)-2-[(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK424021
SMILES CCOC(=O)c1c(scc1c1ccccc1Cl)NC(=O)c1csc2c1CCCC2

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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 C22H20ClNO3S2 MW 445.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO3S2/c1-2-27-22(26)19-15(13-7-3-5-9-17(13)23)11-29-21(19)24-20(25)16-12-28-18-10-6-4-8-14(16)18/h3,5,7,9,11-12H,2,4,6,8,10H2,1H3,(H,24,25)
InChIKey
JKPKJHQYOULVOW-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)C3=CSC4=C3CCCC4
ethyl4(2chlorophenyl)2((4567tetrahydro1benzothiophen3ylcarbonyl)amino)thiophene3carboxylate
ethyl4(2chlorophenyl)2(4567tetrahydro1benzothiophene3carbonylamino)thiophene3carboxylate
InChI=1SC22H20ClNO3S2c122722(26)1915(13735917(13)23)112921(19)2420(25)161228181064814(16)18h35791112H246810H21H3(H2425)
MFCD06758375
ZINC000019644147
ZINC19644147

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Available files

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