Vitas-M small molecule compound
ethyl 4-amino-2-({2-[(6-tert-butyl-3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Catalog ID
STL354619
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)Nc1sc2c(c1C#N)CCC(C2)C(C)(C)C
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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 C22H27N5O3S2 MW 473.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O3S2/c1-5-30-20(29)15-10-25-21(27-18(15)24)31-11-17(28)26-19-14(9-23)13-7-6-12(22(2,3)4)8-16(13)32-19/h10,12H,5-8,11H2,1-4H3,(H,26,28)(H2,24,25,27)InChIKey
CURKMZSQWLPXMN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=C(C3=C(S2)CC(CC3)C(C)(C)C)C#N
ethyl4amino2((2((6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ethyl4amino2(2((6tertbutyl3cyano4567tetrahydro1benzothiophen2yl)amino)2oxoethyl)sulfanylpyrimidine5carboxylate
InChI=1SC22H27N5O3S2c153020(29)15102521(2718(15)24)311117(28)261914(923)137612(22(23)4)816(13)3219h1012H5811H214H3(H2628)(H2242527)
MFCD07178751
ZINC000009235846
ZINC000009235849
Check stock
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