Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-{[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]methyl}-4-[4-(methylsulfanyl)phenyl]-4H-pyran-3-carboxylate
Catalog ID
STK748002
SMILES CCOC(=O)C1=C(CSc2nc(C)c(c(c2C#N)C)C)OC(=C(C1c1ccc(cc1)SC)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 C26H26N4O3S2 MW 506.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3S2/c1-6-32-26(31)23-21(13-35-25-19(11-27)15(3)14(2)16(4)30-25)33-24(29)20(12-28)22(23)17-7-9-18(34-5)10-8-17/h7-10,22H,6,13,29H2,1-5H3InChIKey
BZNQZNVSGFGUKX-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)SC)C#N)N)CSC3=NC(=C(C(=C3C#N)C)C)C
ethyl6amino5cyano2(((3cyano456trimethylpyridin2yl)sulfanyl)methyl)4(4(methylsulfanyl)phenyl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO456TRIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4(4METHYLSULFANYLPHENYL)4HPYRAN3CARBOXYLATE
InChI=1SC26H26N4O3S2c163226(31)2321(13352519(1127)15(3)14(2)16(4)3025)3324(29)20(1228)22(23)177918(345)10817h71022H61329H215H3
MFCD00742686
ZINC000008809594
ZINC000008809595
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