Vitas-M small molecule compound

ethyl 2-{[({4-methyl-5-[2-(methylsulfanyl)ethyl]-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK510620
SMILES CSCCc1[nH]c(nc1C)SCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2

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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 C20H27N3O3S3 MW 453.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O3S3/c1-4-26-19(25)17-13-7-5-6-8-15(13)29-18(17)23-16(24)11-28-20-21-12(2)14(22-20)9-10-27-3/h4-11H2,1-3H3,(H,21,22)(H,23,24)
InChIKey
PBUZLHWMDZKZAZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC(=C(N3)C)CCSC
CSCCc1(nH)c(nc1C)SCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2
ethyl2((((4methyl5(2(methylsulfanyl)ethyl)1Himidazol2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((5methyl4(2methylsulfanylethyl)1Himidazol2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC20H27N3O3S3c142619(25)1713756815(13)2918(17)2316(24)1128202112(2)14(2220)910273h411H213H3(H2122)(H2324)
MFCD04308201
ZINC000012413876
ZINC12413876

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Available files

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