Vitas-M small molecule compound
methyl 4-chloro-2-({[(4-oxo-3-propyl-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetyl}amino)benzoate
Catalog ID
STL028867
SMILES CCCn1c(SCC(=O)Nc2cc(Cl)ccc2C(=O)OC)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)16-13(6-8-28-16)22-19(23)29-10-15(24)21-14-9-11(20)4-5-12(14)18(26)27-2/h4-6,8-9H,3,7,10H2,1-2H3,(H,21,24)InChIKey
NTASBNFKABVYKH-UHFFFAOYSA-NSynonyms
1252824-86-41252824864
CCCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)NC3=C(C=CC(=C3)Cl)C(=O)OC
InChI=1SC19H18ClN3O4S2c1372317(25)1613(682816)2219(23)291015(24)2114911(20)4512(14)18(26)272h4689H3710H212H3(H2124)
methyl4chloro2((((4oxo3propyl34dihydrothieno(32d)pyrimidin2yl)sulfanyl)acetyl)amino)benzoate
methyl4chloro2((2(4oxo3propylthieno(32d)pyrimidin2yl)sulfanylacetyl)amino)benzoate
MFCD18189230
ZINC000057425369
ZINC57425369
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