Vitas-M small molecule compound
ethyl 2-({[(ethoxycarbonothioyl)sulfanyl]acetyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK099472
SMILES CCOC(=S)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 C16H21NO4S3 MW 387.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21NO4S3/c1-3-20-15(19)13-10-7-5-6-8-11(10)24-14(13)17-12(18)9-23-16(22)21-4-2/h3-9H2,1-2H3,(H,17,18)InChIKey
WWHUGXDGPAHRIU-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC(=S)OCC
CCOC(=S)SCC(=O)Nc1sc2c(c1C(=O)OCC)CCCC2
ethyl2((((ethoxycarbonothioyl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2ethoxycarbothioylsulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC16H21NO4S3c132015(19)1310756811(10)2414(13)1712(18)92316(22)2142h39H212H3(H1718)
MFCD08679421
STK099472
ZINC000004677361
ZINC04677361
ZINC4677361
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Check stock on Vitas-MAvailable files
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