Vitas-M small molecule compound

ethyl 6-amino-5-cyano-2-({[3-cyano-6-(thiophen-2-yl)pyridin-2-yl]sulfanyl}methyl)-4-phenyl-4H-pyran-3-carboxylate

Catalog ID
STK748015
SMILES CCOC(=O)C1=C(CSc2nc(ccc2C#N)c2cccs2)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 C26H20N4O3S2 MW 500.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4O3S2/c1-2-32-26(31)23-20(33-24(29)18(14-28)22(23)16-7-4-3-5-8-16)15-35-25-17(13-27)10-11-19(30-25)21-9-6-12-34-21/h3-12,22H,2,15,29H2,1H3
InChIKey
RSYMQNGOPUATOP-UHFFFAOYSA-N
Synonyms
339187-39-2
339187392
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C#N)N)CSC3=C(C=CC(=N3)C4=CC=CS4)C#N
ETHYL(4R)6AMINO5CYANO2(((3CYANO6(THIOPHEN2YL)PYRIDIN2YL)SULFANYL)METHYL)4PHENYL4HPYRAN3CARBOXYLATE
ETHYL(4S)6AMINO5CYANO2(((3CYANO6(THIOPHEN2YL)PYRIDIN2YL)SULFANYL)METHYL)4PHENYL4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2(((3CYANO6(THIOPHEN2YL)PYRIDIN2YL)SULFANYL)METHYL)4PHENYL4HPYRAN3CARBOXYLATE
ethyl6amino5cyano2(((3cyano6(thiophen2yl)pyridin2yl)thio)methyl)4phenyl4Hpyran3carboxylate
ETHYL6AMINO5CYANO2(((3CYANO6THIOPHEN2YLPYRIDIN2YL)SULFANYL)METHYL)4PHENYL4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2((3CYANO6THIOPHEN2YLPYRIDIN2YL)SULFANYLMETHYL)4PHENYL4HPYRAN3CARBOXYLATE
InChI=1SC26H20N4O3S2c123226(31)2320(3324(29)18(1428)22(23)167435816)15352517(1327)101119(3025)2196123421h31222H21529H21H3
MFCD00742705
ZINC000008406160
ZINC000008406169

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Available files

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