Vitas-M small molecule compound
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(4-bromo-2-methylphenyl)acetamide
Catalog ID
STL347625
SMILES O=C(Nc1ccc(cc1C)Br)CSc1ncnc2c1cnn2Cc1ccccc1
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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 C21H18BrN5OS MW 468.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrN5OS/c1-14-9-16(22)7-8-18(14)26-19(28)12-29-21-17-10-25-27(20(17)23-13-24-21)11-15-5-3-2-4-6-15/h2-10,13H,11-12H2,1H3,(H,26,28)InChIKey
LVNPBGSNTHTTRY-UHFFFAOYSA-NSynonyms
861122-59-02((1benzyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(4bromo2methylphenyl)acetamide
2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)thio)N(4bromo2methylphenyl)acetamide
2(1BENZYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(4BROMO2METHYLPHENYL)ACETAMIDE
861122590
CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4
InChI=1SC21H18BrN5OSc114916(22)7818(14)2619(28)12292117102527(20(17)23132421)11155324615h21013H1112H21H3(H2628)
MFCD04015387
ZINC000009307794
ZINC09307794
ZINC9307794
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