Vitas-M small molecule compound
8-[(2E)-2-(1-benzyl-5-bromo-3-oxo-1,3-dihydro-2H-indol-2-ylidene)hydrazinyl]adenosine
Catalog ID
STL529442
SMILES OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)n1c(N/N=C\2/N(Cc3ccccc3)c3c(C2=O)cc(cc3)Br)nc2c1ncnc2N
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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 C25H23BrN8O5 MW 595.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23BrN8O5/c26-13-6-7-15-14(8-13)18(36)23(33(15)9-12-4-2-1-3-5-12)31-32-25-30-17-21(27)28-11-29-22(17)34(25)24-20(38)19(37)16(10-35)39-24/h1-8,11,16,19-20,24,35,37-38H,9-10H2,(H,30,32)(H2,27,28,29)/b31-23+/t16-,19-,20-,24-/m1/s1InChIKey
WCLWEFAYCXJCOR-BDFFUANISA-NSynonyms
(Z)2(2(6amino9((2R3R4S5R)34dihydroxy5(hydroxymethyl)tetrahydrofuran2yl)9Hpurin8yl)hydrazono)1benzyl5bromoindolin3one
8((2E)2(1benzyl5bromo3oxo13dihydro2Hindol2ylidene)hydrazinyl)adenosine
InChI=1SC25H23BrN8O5c2613671514(813)18(36)23(33(15)9124213512)313225301721(27)28112922(17)34(25)2420(38)19(37)16(1035)3924h181116192024353738H910H2(H3032)(H2272829)b3123+t16192024m1s1
MFCD05734640
OC(C@H)1O(C@H)((C@@H)((C@@H)1O)O)n1c(NN=C2N(Cc3ccccc3)c3c(C2=O)cc(cc3)Br)nc2c1ncnc2N
ZINC000070680748
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