Vitas-M small molecule compound
2-{[1-(4-bromophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(3,4-dimethylphenyl)acetamide
Catalog ID
STL348734
SMILES O=C(Nc1ccc(c(c1)C)C)CSc1ncnc2c1cnn2c1ccc(cc1)Br
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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/c1-13-3-6-16(9-14(13)2)26-19(28)11-29-21-18-10-25-27(20(18)23-12-24-21)17-7-4-15(22)5-8-17/h3-10,12H,11H2,1-2H3,(H,26,28)InChIKey
CWLBSQYBDGJFJK-UHFFFAOYSA-NSynonyms
850241-69-92((1(4bromophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(34dimethylphenyl)acetamide
2((1(4bromophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)N(34dimethylphenyl)acetamide
2(1(4BROMOPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(34DIMETHYLPHENYL)ACETAMIDE
850241699
CC1=C(C=C(C=C1)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Br)C
InChI=1SC21H18BrN5OSc1133616(914(13)2)2619(28)11292118102527(20(18)23122421)177415(22)5817h31012H11H212H3(H2628)
MFCD05691943
ZINC000002380415
ZINC02380415
ZINC2380415
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