Vitas-M small molecule compound
4-(2-amino-3,5-dicyano-6-{[2-oxo-2-(2-oxo-2H-chromen-3-yl)ethyl]sulfanyl}pyridin-4-yl)phenyl acetate
Catalog ID
STK527379
SMILES N#Cc1c(SCC(=O)c2cc3ccccc3oc2=O)nc(c(c1c1ccc(cc1)OC(=O)C)C#N)N
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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 C26H16N4O5S MW 496.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H16N4O5S/c1-14(31)34-17-8-6-15(7-9-17)23-19(11-27)24(29)30-25(20(23)12-28)36-13-21(32)18-10-16-4-2-3-5-22(16)35-26(18)33/h2-10H,13H2,1H3,(H2,29,30)InChIKey
FRYMQFOPGFWUBF-UHFFFAOYSA-NSynonyms
221178-89-8(4(2AMINO35DICYANO6(2OXO2(2OXOCHROMEN3YL)ETHYL)SULFANYLPYRIDIN4YL)PHENYL)ACETATE
221178898
4(2amino35dicyano6((2oxo2(2oxo2Hchromen3yl)ethyl)sulfanyl)pyridin4yl)phenylacetate
4(2amino35dicyano6((2oxo2(2oxo2Hchromen3yl)ethyl)thio)pyridin4yl)phenylacetate
CC(=O)OC1=CC=C(C=C1)C2=C(C(=NC(=C2C#N)SCC(=O)C3=CC4=CC=CC=C4OC3=O)N)C#N
InChI=1SC26H16N4O5Sc114(31)34178615(7917)2319(1127)24(29)3025(20(23)1228)361321(32)181016423522(16)3526(18)33h210H13H21H3(H22930)
MFCD00306829
ZINC000020840449
ZINC20840449
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