Vitas-M small molecule compound
ethyl [(5-{[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]acetate
Catalog ID
STL079719
SMILES CCOC(=O)CSc1nnc(n1c1ccccc1)CSc1nc(N)c2c(n1)sc(c2C)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 C21H22N6O2S3 MW 486.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N6O2S3/c1-4-29-16(28)11-31-21-26-25-15(27(21)14-8-6-5-7-9-14)10-30-20-23-18(22)17-12(2)13(3)32-19(17)24-20/h5-9H,4,10-11H2,1-3H3,(H2,22,23,24)InChIKey
WMZSRLKAOKEYIJ-UHFFFAOYSA-NSynonyms
433690-60-9433690609
CCOC(=O)CSC1=NN=C(N1C2=CC=CC=C2)CSC3=NC(=C4C(=C(SC4=N3)C)C)N
ethyl((5(((4amino56dimethylthieno(23d)pyrimidin2yl)sulfanyl)methyl)4phenyl4H124triazol3yl)sulfanyl)acetate
ETHYL2((5(((4AMINO56DIMETHYLTHIENO(23D)PYRIMIDIN2YL)THIO)METHYL)4PHENYL4H124TRIAZOL3YL)THIO)ACETATE
ETHYL2((5((4AMINO56DIMETHYLTHIENO(23D)PYRIMIDIN2YL)SULFANYLMETHYL)4PHENYL124TRIAZOL3YL)SULFANYL)ACETATE
ETHYL2(5((4AMINO56DIMETHYLTHIOPHENO(23D)PYRIMIDIN2YLTHIO)METHYL)4PHENYL124TRIAZOL3YLTHIO)ACETATE
InChI=1SC21H22N6O2S3c142916(28)113121262515(27(21)148657914)1030202318(22)1712(2)13(3)3219(17)2420h59H41011H213H3(H2222324)
MFCD03109915
ZINC000001802822
ZINC01802822
ZINC1802822
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