Vitas-M small molecule compound
2-{[1-(4-bromophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-N-(2,6-dibromo-4-methylphenyl)acetamide
Catalog ID
STL055836
SMILES O=C(Nc1c(Br)cc(cc1Br)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 C20H14Br3N5OS MW 612.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14Br3N5OS/c1-11-6-15(22)18(16(23)7-11)27-17(29)9-30-20-14-8-26-28(19(14)24-10-25-20)13-4-2-12(21)3-5-13/h2-8,10H,9H2,1H3,(H,27,29)InChIKey
XZVXOCSTMAGWPY-UHFFFAOYSA-NSynonyms
714233-30-42((1(4bromophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)N(26dibromo4methylphenyl)acetamide
2((1(4bromophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)N(26dibromo4methylphenyl)acetamide
2(1(4BROMOPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYLN(26DIBROMO4METHYLPHENYL)ACETAMIDE
714233304
CC1=CC(=C(C(=C1)Br)NC(=O)CSC2=NC=NC3=C2C=NN3C4=CC=C(C=C4)Br)Br
InChI=1SC20H14Br3N5OSc111615(22)18(16(23)711)2717(29)930201482628(19(14)24102520)134212(21)3513h2810H9H21H3(H2729)
MFCD05728603
ZINC000101674317
ZINC101674317
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