Vitas-M small molecule compound
ethyl 3-{3-amino-4-cyano-5-[(2,4-dichlorobenzyl)sulfanyl]thiophen-2-yl}-3-oxopropanoate
Catalog ID
STK651835
SMILES CCOC(=O)CC(=O)c1sc(c(c1N)C#N)SCc1ccc(cc1Cl)Cl
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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 C17H14Cl2N2O3S2 MW 429.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14Cl2N2O3S2/c1-2-24-14(23)6-13(22)16-15(21)11(7-20)17(26-16)25-8-9-3-4-10(18)5-12(9)19/h3-5H,2,6,8,21H2,1H3InChIKey
VYPHIUZZYRKACN-UHFFFAOYSA-NSynonyms
1043384-32-21043384322
CCOC(=O)CC(=O)C1=C(C(=C(S1)SCC2=C(C=C(C=C2)Cl)Cl)C#N)N
ethyl3(3amino4cyano5((24dichlorobenzyl)sulfanyl)thiophen2yl)3oxopropanoate
ethyl3(3amino4cyano5((24dichlorobenzyl)thio)thiophen2yl)3oxopropanoate
ethyl3(3amino4cyano5((24dichlorophenyl)methylsulfanyl)thiophen2yl)3oxopropanoate
InChI=1SC17H14Cl2N2O3S2c122414(23)613(22)1615(21)11(720)17(2616)25893410(18)512(9)19h35H26821H21H3
MFCD13757854
ZINC000036358343
ZINC36358343
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