Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-{[(3-cyano-6-ethyl-5-methylpyridin-2-yl)sulfanyl]methyl}-4-(thiophen-2-yl)-4H-pyran-3-carboxylate
Catalog ID
STK748631
SMILES CCOC(=O)C1=C(CSc2nc(CC)c(cc2C#N)C)OC(=C(C1c1cccs1)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 C23H22N4O3S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N4O3S2/c1-4-16-13(3)9-14(10-24)22(27-16)32-12-17-20(23(28)29-5-2)19(18-7-6-8-31-18)15(11-25)21(26)30-17/h6-9,19H,4-5,12,26H2,1-3H3InChIKey
PZCABGUUIANCEU-UHFFFAOYSA-NSynonyms
339580-58-4339580584
CCC1=C(C=C(C(=N1)SCC2=C(C(C(=C(O2)N)C#N)C3=CC=CS3)C(=O)OCC)C#N)C
ethyl6amino5cyano2(((3cyano6ethyl5methylpyridin2yl)sulfanyl)methyl)4(thiophen2yl)4Hpyran3carboxylate
ethyl6amino5cyano2(((3cyano6ethyl5methylpyridin2yl)thio)methyl)4(thiophen2yl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO6ETHYL5METHYLPYRIDIN2YL)SULFANYLMETHYL)4THIOPHEN2YL4HPYRAN3CARBOXYLATE
InChI=1SC23H22N4O3S2c141613(3)914(1024)22(2716)32121720(23(28)2952)19(187683118)15(1125)21(26)3017h6919H451226H213H3
MFCD00743611
ZINC000008965458
ZINC000008965459
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