Vitas-M small molecule compound
ethyl 4-{[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanyl}-3-oxobutanoate
Catalog ID
STK886887
SMILES CCOC(=O)CC(=O)CSc1nc(ccc1C#N)c1ccc(cc1)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 C18H15ClN2O3S MW 374.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN2O3S/c1-2-24-17(23)9-15(22)11-25-18-13(10-20)5-8-16(21-18)12-3-6-14(19)7-4-12/h3-8H,2,9,11H2,1H3InChIKey
LNWHENDVEFDBSB-UHFFFAOYSA-NSynonyms
CCOC(=O)CC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N
ethyl4((6(4chlorophenyl)3cyanopyridin2yl)sulfanyl)3oxobutanoate
ethyl4(6(4chlorophenyl)3cyanopyridin2yl)sulfanyl3oxobutanoate
InChI=1SC18H15ClN2O3Sc122417(23)915(22)11251813(1020)5816(2118)123614(19)7412h38H2911H21H3
MFCD10087524
ZINC000012250948
ZINC12250948
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