Vitas-M small molecule compound
ethyl 2-{[({5-cyano-4-[4-(dimethylamino)phenyl]-6-oxo-1,6-dihydropyrimidin-2-yl}sulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL497353
SMILES CCOC(=O)c1c(NC(=O)CSc2[nH]c(=O)c(c(n2)c2ccc(cc2)N(C)C)C#N)sc2c1CCCC2
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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 C26H27N5O4S2 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O4S2/c1-4-35-25(34)21-17-7-5-6-8-19(17)37-24(21)28-20(32)14-36-26-29-22(18(13-27)23(33)30-26)15-9-11-16(12-10-15)31(2)3/h9-12H,4-8,14H2,1-3H3,(H,28,32)(H,29,30,33)InChIKey
YVRRCEDDGYKQHH-UHFFFAOYSA-NSynonyms
4635875
ethyl2((((5cyano4(4(dimethylamino)phenyl)6oxo16dihydropyrimidin2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2((5cyano6(4(dimethylamino)phenyl)4oxo1Hpyrimidin2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC26H27N5O4S2c143525(34)2117756819(17)3724(21)2820(32)1436262922(18(1327)23(33)3026)1591116(121015)31(2)3h912H4814H213H3(H2832)(H293033)
MFCD02042123
ZINC000103620691
Check stock
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Check stock on Vitas-MAvailable files
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