Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-{[(3-cyano-4-methyl-6-oxo-1,6-dihydropyridin-2-yl)sulfanyl]methyl}-4-phenyl-4H-pyran-3-carboxylate
Catalog ID
STL232350
SMILES CCOC(=O)C1=C(CSc2[nH]c(=O)cc(c2C#N)C)OC(=C(C1c1ccccc1)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 C23H20N4O4S MW 448.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O4S/c1-3-30-23(29)20-17(12-32-22-15(10-24)13(2)9-18(28)27-22)31-21(26)16(11-25)19(20)14-7-5-4-6-8-14/h4-9,19H,3,12,26H2,1-2H3,(H,27,28)InChIKey
DUSGPOVEUXNTMS-UHFFFAOYSA-NSynonyms
298217-13-7298217137
CCOC(=O)C1=C(CSc2(nH)c(=O)cc(c2C#N)C)OC(=C(C1c1ccccc1)C#N)N
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C#N)N)CSC3=C(C(=CC(=O)N3)C)C#N
ethyl6amino5cyano2(((3cyano4methyl6oxo16dihydropyridin2yl)sulfanyl)methyl)4phenyl4Hpyran3carboxylate
ethyl6amino5cyano2(((3cyano4methyl6oxo16dihydropyridin2yl)thio)methyl)4phenyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO4METHYL6OXO1HPYRIDIN2YL)SULFANYLMETHYL)4PHENYL4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2((3CYANO6HYDROXY4METHYL(2PYRIDYLTHIO))METHYL)4PHENYL4HPYRAN3CARBOXYLATE
InChI=1SC23H20N4O4Sc133023(29)2017(12322215(1024)13(2)918(28)2722)3121(26)16(1125)19(20)147546814h4919H31226H212H3(H2728)
MFCD00712388
ZINC000003072670
ZINC000003072671
Check stock
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Check stock on Vitas-MAvailable files
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