Vitas-M small molecule compound
ethyl 6-amino-5-cyano-2-{[(3-cyano-6,7-dihydro-5H-cyclopenta[b]pyridin-2-yl)sulfanyl]methyl}-4-[4-(methylsulfanyl)phenyl]-4H-pyran-3-carboxylate
Catalog ID
STK748632
SMILES CCOC(=O)C1=C(CSc2nc3CCCc3cc2C#N)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 C26H24N4O3S2 MW 504.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24N4O3S2/c1-3-32-26(31)23-21(14-35-25-17(12-27)11-16-5-4-6-20(16)30-25)33-24(29)19(13-28)22(23)15-7-9-18(34-2)10-8-15/h7-11,22H,3-6,14,29H2,1-2H3InChIKey
NWSXMXVMPONZPL-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(C=C2)SC)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N
ETHYL6AMINO5CYANO2(((3CYANO67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)SULFANYL)METHYL)4(4(METHYLSULFANYL)PHENYL)4HPYRAN3CARBOXYLATE
ETHYL6AMINO5CYANO2((3CYANO67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)SULFANYLMETHYL)4(4METHYLSULFANYLPHENYL)4HPYRAN3CARBOXYLATE
InChI=1SC26H24N4O3S2c133226(31)2321(14352517(1227)111654620(16)3025)3324(29)19(1328)22(23)157918(342)10815h71122H361429H212H3
MFCD00743612
ZINC000008406196
ZINC000008406200
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