Vitas-M small molecule compound
methyl 6-amino-5-cyano-2-{[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanyl]methyl}-4-(pyridin-3-yl)-4H-pyran-3-carboxylate
Catalog ID
STK012685
SMILES COC(=O)C1=C(CSc2nc(C)cc(c2C#N)C)OC(=C(C1c1cccnc1)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 C22H19N5O3S MW 433.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O3S/c1-12-7-13(2)27-21(15(12)8-23)31-11-17-19(22(28)29-3)18(14-5-4-6-26-10-14)16(9-24)20(25)30-17/h4-7,10,18H,11,25H2,1-3H3InChIKey
NUGYPODQGRYJRW-UHFFFAOYSA-NSynonyms
354554-90-8354554908
CC1=CC(=NC(=C1C#N)SCC2=C(C(C(=C(O2)N)C#N)C3=CN=CC=C3)C(=O)OC)C
COC(=O)C1=C(CSc2nc(C)cc(c2C#N)C)OC(=C(C1c1cccnc1)C#N)N
InChI=1SC22H19N5O3Sc112713(2)2721(15(12)823)31111719(22(28)293)18(14546261014)16(924)20(25)3017h471018H1125H213H3
METHYL(4S)6AMINO5CYANO2(((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYL)METHYL)4(PYRIDIN3YL)4HPYRAN3CARBOXYLATE
METHYL6AMINO5CYANO2(((3CYANO46DIMETHYL2PYRIDINYL)SULFANYL)METHYL)4(3PYRIDINYL)4HPYRAN3CARBOXYLATE
METHYL6AMINO5CYANO2(((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYL)METHYL)4(PYRIDIN3YL)4HPYRAN3CARBOXYLATE
methyl6amino5cyano2(((3cyano46dimethylpyridin2yl)thio)methyl)4(pyridin3yl)4Hpyran3carboxylate
METHYL6AMINO5CYANO2((3CYANO46DIMETHYLPYRIDIN2YL)SULFANYLMETHYL)4PYRIDIN3YL4HPYRAN3CARBOXYLATE
MFCD01835881
STK012685
ZINC000002118209
ZINC000008451018
Check stock
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Check stock on Vitas-MAvailable files
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