Vitas-M small molecule compound

ethyl 2-{[3-(acetylsulfanyl)propanoyl]amino}-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate

Catalog ID
STK280143
SMILES CCOC(=O)c1c(NC(=O)CCSC(=O)C)sc(c1C)C(=O)Nc1ccccc1

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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 C20H22N2O5S2 MW 434.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N2O5S2/c1-4-27-20(26)16-12(2)17(18(25)21-14-8-6-5-7-9-14)29-19(16)22-15(24)10-11-28-13(3)23/h5-9H,4,10-11H2,1-3H3,(H,21,25)(H,22,24)
InChIKey
KIDIXVVGFUIVMO-UHFFFAOYSA-N
Synonyms
312497-64-6
312497646
CCOC(=O)C1=C(SC(=C1C)C(=O)NC2=CC=CC=C2)NC(=O)CCSC(=O)C
ethyl2((3(acetylsulfanyl)propanoyl)amino)4methyl5(phenylcarbamoyl)thiophene3carboxylate
ETHYL2(3ACETYLSULFANYLPROPANOYLAMINO)4METHYL5(PHENYLCARBAMOYL)THIOPHENE3CARBOXYLATE
InChI=1SC20H22N2O5S2c142720(26)1612(2)17(18(25)21148657914)2919(16)2215(24)10112813(3)23h59H41011H213H3(H2125)(H2224)
MFCD01044396
ZINC000002951814
ZINC02951814
ZINC2951814

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Available files

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