Vitas-M small molecule compound
ethyl 6-amino-2-({[6-amino-3,5-dicyano-4-(4-fluorophenyl)pyridin-2-yl]sulfanyl}methyl)-5-cyano-4-phenyl-4H-pyran-3-carboxylate
Catalog ID
STK669561
SMILES CCOC(=O)C1=C(CSc2nc(N)c(c(c2C#N)c2ccc(cc2)F)C#N)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 C29H21FN6O3S MW 552.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21FN6O3S/c1-2-38-29(37)25-22(39-27(35)20(13-32)24(25)16-6-4-3-5-7-16)15-40-28-21(14-33)23(19(12-31)26(34)36-28)17-8-10-18(30)11-9-17/h3-11,24H,2,15,35H2,1H3,(H2,34,36)InChIKey
LSCXICBLVYWXCH-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2)C#N)N)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)F)C#N
ETHYL(4S)6AMINO2(((6AMINO35DICYANO4(4FLUOROPHENYL)PYRIDIN2YL)SULFANYL)METHYL)5CYANO4PHENYL4HPYRAN3CARBOXYLATE
ethyl6amino2(((6amino35dicyano4(4fluorophenyl)pyridin2yl)sulfanyl)methyl)5cyano4phenyl4Hpyran3carboxylate
ethyl6amino2(((6amino35dicyano4(4fluorophenyl)pyridin2yl)thio)methyl)5cyano4phenyl4Hpyran3carboxylate
ETHYL6AMINO2((6AMINO35DICYANO4(4FLUOROPHENYL)PYRIDIN2YL)SULFANYLMETHYL)5CYANO4PHENYL4HPYRAN3CARBOXYLATE
InChI=1SC29H21FN6O3Sc123829(37)2522(3927(35)20(1332)24(25)166435716)15402821(1433)23(19(1231)26(34)3628)1781018(30)11917h31124H21535H21H3(H23436)
MFCD00743893
ZINC000033354358
ZINC000033354364
Check stock
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Check stock on Vitas-MAvailable files
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