Vitas-M small molecule compound

ethyl 6-amino-5-cyano-2-{[(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanyl]methyl}-4-(4-methoxyphenyl)-4H-pyran-3-carboxylate

Catalog ID
STK748010
SMILES CCOC(=O)C1=C(CSc2nc(C)c(c(c2C#N)C)C)OC(=C(C1c1ccc(cc1)OC)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 C26H26N4O4S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O4S/c1-6-33-26(31)23-21(13-35-25-19(11-27)15(3)14(2)16(4)30-25)34-24(29)20(12-28)22(23)17-7-9-18(32-5)10-8-17/h7-10,22H,6,13,29H2,1-5H3
InChIKey
QYBDJDCLVKWIAO-UHFFFAOYSA-N
Synonyms
296798-77-1
296798771
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)OC)C#N)N)CSC3=NC(=C(C(=C3C#N)C)C)C
ethyl6amino5cyano2(((3cyano456trimethylpyridin2yl)sulfanyl)methyl)4(4methoxyphenyl)4Hpyran3carboxylate
ethyl6amino5cyano2(((3cyano456trimethylpyridin2yl)thio)methyl)4(4methoxyphenyl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO456TRIMETHYL(2PYRIDYLTHIO))METHYL)4(4METHOXYPHENYL)4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2((3CYANO456TRIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4(4METHOXYPHENYL)4HPYRAN3CARBOXYLATE
InChI=1SC26H26N4O4Sc163326(31)2321(13352519(1127)15(3)14(2)16(4)3025)3424(29)20(1228)22(23)177918(325)10817h71022H61329H215H3
MFCD00742699
ZINC000008763985
ZINC000008763986

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Available files

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