Vitas-M small molecule compound
2-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide
Catalog ID
STL346737
SMILES O=C(Nc1c(C)cc(cc1C)C)CSc1ncnc2c1cnn2c1ccc(cc1)Cl
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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 C22H20ClN5OS MW 437.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClN5OS/c1-13-8-14(2)20(15(3)9-13)27-19(29)11-30-22-18-10-26-28(21(18)24-12-25-22)17-6-4-16(23)5-7-17/h4-10,12H,11H2,1-3H3,(H,27,29)InChIKey
SCUCGVQRKKSELB-UHFFFAOYSA-NSynonyms
573936-40-02((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(246trimethylphenyl)acetamide
2((1(4CHLOROPHENYL)1HPYRAZOLO(34D)PYRIMIDIN4YL)THIO)NMESITYLACETAMIDE
2(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(246TRIMETHYLPHENYL)ACETAMIDE
573936400
CC1=CC(=C(C(=C1)C)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Cl)C
InChI=1SC22H20ClN5OSc113814(2)20(15(3)913)2719(29)11302218102628(21(18)24122522)176416(23)5717h41012H11H213H3(H2729)
MFCD04020122
ZINC000002446857
ZINC02446857
ZINC2446857
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