Vitas-M small molecule compound
ethyl {[3,5-dicyano-4-(2-ethoxyphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}acetate
Catalog ID
STK763783
SMILES CCOC(=O)CSC1=C(C#N)C(C(C(=O)N1)C#N)c1ccccc1OCC
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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 C19H19N3O4S MW 385.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N3O4S/c1-3-25-15-8-6-5-7-12(15)17-13(9-20)18(24)22-19(14(17)10-21)27-11-16(23)26-4-2/h5-8,13,17H,3-4,11H2,1-2H3,(H,22,24)InChIKey
LZOWUCRAMRNJNQ-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C2C(C(=O)NC(=C2C#N)SCC(=O)OCC)C#N
ethyl((35dicyano4(2ethoxyphenyl)6oxo1456tetrahydropyridin2yl)sulfanyl)acetate
ETHYL2((35DICYANO4(2ETHOXYPHENYL)2OXO34DIHYDRO1HPYRIDIN6YL)SULFANYL)ACETATE
InChI=1SC19H19N3O4Sc132515865712(15)1713(920)18(24)2219(14(17)1021)271116(23)2642h581317H3411H212H3(H2224)
MFCD02232561
ZINC000000875432
ZINC000000875437
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