Vitas-M small molecule compound
ethyl 6-amino-2-({[6-amino-3,5-dicyano-4-(4-fluorophenyl)pyridin-2-yl]sulfanyl}methyl)-4-(2-chlorophenyl)-5-cyano-4H-pyran-3-carboxylate
Catalog ID
STK669563
SMILES CCOC(=O)C1=C(CSc2nc(N)c(c(c2C#N)c2ccc(cc2)F)C#N)OC(=C(C1c1ccccc1Cl)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 C29H20ClFN6O3S MW 587.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H20ClFN6O3S/c1-2-39-29(38)25-22(40-27(36)19(12-33)24(25)17-5-3-4-6-21(17)30)14-41-28-20(13-34)23(18(11-32)26(35)37-28)15-7-9-16(31)10-8-15/h3-10,24H,2,14,36H2,1H3,(H2,35,37)InChIKey
VZEPAVHPUITXMS-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2Cl)C#N)N)CSC3=C(C(=C(C(=N3)N)C#N)C4=CC=C(C=C4)F)C#N
ETHYL(4R)6AMINO2(((6AMINO35DICYANO4(4FLUOROPHENYL)PYRIDIN2YL)SULFANYL)METHYL)4(2CHLOROPHENYL)5CYANO4HPYRAN3CARBOXYLATE
ethyl6amino2(((6amino35dicyano4(4fluorophenyl)pyridin2yl)sulfanyl)methyl)4(2chlorophenyl)5cyano4Hpyran3carboxylate
ethyl6amino2(((6amino35dicyano4(4fluorophenyl)pyridin2yl)thio)methyl)4(2chlorophenyl)5cyano4Hpyran3carboxylate
ETHYL6AMINO2((6AMINO35DICYANO4(4FLUOROPHENYL)PYRIDIN2YL)SULFANYLMETHYL)4(2CHLOROPHENYL)5CYANO4HPYRAN3CARBOXYLATE
InChI=1SC29H20ClFN6O3Sc123929(38)2522(4027(36)19(1233)24(25)17534621(17)30)14412820(1334)23(18(1132)26(35)3728)157916(31)10815h31024H21436H21H3(H23537)
MFCD00743896
ZINC000035973882
ZINC000053277211
Check stock
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Check stock on Vitas-MAvailable files
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