Vitas-M small molecule compound
methyl 5-chloro-2-({[(4-oxo-3-propyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL028866
SMILES CCCn1c(SCC(=O)Nc2ccc(cc2C(=O)OC)Cl)nc2c(c1=O)scc2
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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 C19H18ClN3O4S2 MW 451.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O4S2/c1-3-7-23-17(25)16-14(6-8-28-16)22-19(23)29-10-15(24)21-13-5-4-11(20)9-12(13)18(26)27-2/h4-6,8-9H,3,7,10H2,1-2H3,(H,21,24)InChIKey
BENQWEIOVGANIE-UHFFFAOYSA-NSynonyms
1252915-26-61252915266
CCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=C(C=C(C=C3)Cl)C(=O)OC
InChI=1SC19H18ClN3O4S2c1372317(25)1614(682816)2219(23)291015(24)21135411(20)912(13)18(26)272h4689H3710H212H3(H2124)
methyl5chloro2((((4oxo3propyl34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl5chloro2((2(4oxo3propylthieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18189229
ZINC000057425366
ZINC57425366
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