Vitas-M small molecule compound

ethyl 2-{[(3,4-dichloro-1-benzothiophen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK423006
SMILES CCOC(=O)c1c(sc2c1CCCC2)NC(=O)c1sc2c(c1Cl)c(Cl)ccc2

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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 C20H17Cl2NO3S2 MW 454.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17Cl2NO3S2/c1-2-26-20(25)14-10-6-3-4-8-12(10)28-19(14)23-18(24)17-16(22)15-11(21)7-5-9-13(15)27-17/h5,7,9H,2-4,6,8H2,1H3,(H,23,24)
InChIKey
QLBRWHHPEAYSJT-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=C(C4=C(S3)C=CC=C4Cl)Cl
ethyl2(((34dichloro1benzothiophen2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((34dichloro1benzothiophene2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H17Cl2NO3S2c122620(25)1410634812(10)2819(14)2318(24)1716(22)1511(21)75913(15)2717h579H2468H21H3(H2324)
MFCD01072306
ZINC000002769010
ZINC02769010
ZINC2769010

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Available files

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