Vitas-M small molecule compound
4-bromo-2-[(E)-{2-[2,6-di(pyrrolidin-1-yl)pyrimidin-4-yl]hydrazinylidene}methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STK072343
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1/C=N/Nc1cc(nc(n1)N1CCCC1)N1CCCC1)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 C26H29BrN6O3S MW 585.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29BrN6O3S/c1-19-6-9-22(10-7-19)37(34,35)36-23-11-8-21(27)16-20(23)18-28-31-24-17-25(32-12-2-3-13-32)30-26(29-24)33-14-4-5-15-33/h6-11,16-18H,2-5,12-15H2,1H3,(H,29,30,31)/b28-18+InChIKey
DNOJNHRHUZKCLU-MTDXEUNCSA-NSynonyms
(4bromo2((E)((26dipyrrolidin1ylpyrimidin4yl)hydrazinylidene)methyl)phenyl)4methylbenzenesulfonate
4BROMO2((E)(2(26DI(PYRROLIDIN1YL)PYRIMIDIN4YL)HYDRAZINYLIDENE)METHYL)PHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Br)C=NNC3=NC(=NC(=C3)N4CCCC4)N5CCCC5
Cc1ccc(cc1)S(=O)(=O)Oc1ccc(cc1C=NNc1cc(nc(n1)N1CCCC1)N1CCCC1)Br
InChI=1SC26H29BrN6O3Sc1196922(10719)37(3435)362311821(27)1620(23)182831241725(3212231332)3026(2924)3314451533h6111618H251215H21H3(H293031)b2818+
MFCD02199213
STK072343
ZINC000097958957
ZINC100140300
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