Vitas-M small molecule compound
2-[(1-benzyl-1H-pyrazolo[3,4-d]pyrimidin-4-yl)sulfanyl]-N-(3-chloro-2-methylphenyl)acetamide
Catalog ID
STL347091
SMILES O=C(Nc1cccc(c1C)Cl)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 C21H18ClN5OS MW 423.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN5OS/c1-14-17(22)8-5-9-18(14)26-19(28)12-29-21-16-10-25-27(20(16)23-13-24-21)11-15-6-3-2-4-7-15/h2-10,13H,11-12H2,1H3,(H,26,28)InChIKey
GXBRBZAVHRIVFH-UHFFFAOYSA-NSynonyms
578697-13-92((1benzyl1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(3chloro2methylphenyl)acetamide
2((1benzyl1Hpyrazolo(34d)pyrimidin4yl)thio)N(3chloro2methylphenyl)acetamide
2(1BENZYLPYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(3CHLORO2METHYLPHENYL)ACETAMIDE
578697139
CC1=C(C=CC=C1Cl)NC(=O)CSC2=NC=NC3=C2C=NN3CC4=CC=CC=C4
InChI=1SC21H18ClN5OSc11417(22)85918(14)2619(28)12292116102527(20(16)23132421)11156324715h21013H1112H21H3(H2628)
MFCD04028955
ZINC000002451599
ZINC02451599
ZINC2451599
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