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-(thiophen-2-yl)-4H-pyran-3-carboxylate
Catalog ID
STK748630
SMILES CCOC(=O)C1=C(CSc2nc3CCCc3cc2C#N)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 C23H20N4O3S2 MW 464.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20N4O3S2/c1-2-29-23(28)20-17(30-21(26)15(11-25)19(20)18-7-4-8-31-18)12-32-22-14(10-24)9-13-5-3-6-16(13)27-22/h4,7-9,19H,2-3,5-6,12,26H2,1H3InChIKey
AWPCLNCUMYCSEU-UHFFFAOYSA-NSynonyms
336180-77-9336180779
CCOC(=O)C1=C(OC(=C(C1C2=CC=CS2)C#N)N)CSC3=NC4=C(CCC4)C=C3C#N
ethyl6amino5cyano2(((3cyano67dihydro5Hcyclopenta(b)pyridin2yl)sulfanyl)methyl)4(thiophen2yl)4Hpyran3carboxylate
ethyl6amino5cyano2(((3cyano67dihydro5Hcyclopenta(b)pyridin2yl)thio)methyl)4(thiophen2yl)4Hpyran3carboxylate
ETHYL6AMINO5CYANO2((3CYANO67DIHYDRO5HCYCLOPENTA(B)PYRIDIN2YL)SULFANYLMETHYL)4THIOPHEN2YL4HPYRAN3CARBOXYLATE
InChI=1SC23H20N4O3S2c122923(28)2017(3021(26)15(1125)19(20)187483118)12322214(1024)91353616(13)2722h47919H23561226H21H3
MFCD00743610
ZINC000006089270
ZINC000006089273
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