Vitas-M small molecule compound
8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-6-hydroxy-7-(2-methoxyethyl)-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK632525
SMILES COCCn1c(N/N=C/C(=C/c2ccccc2)/Br)nc2c1c(O)nc(=O)n2C
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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 C18H19BrN6O3 MW 447.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19BrN6O3/c1-24-15-14(16(26)22-18(24)27)25(8-9-28-2)17(21-15)23-20-11-13(19)10-12-6-4-3-5-7-12/h3-7,10-11H,8-9H2,1-2H3,(H,21,23)(H,22,26,27)/b13-10-,20-11+InChIKey
NHRFJJDNYDGSLH-ULCUFOFXSA-NSynonyms
333769-28-1333769281
8(((3Z1E)3BROMO4PHENYL1AZABUTA13DIENYL)AMINO)7(2METHOXYETHYL)3METHYL137TRIHYDROPURINE26DIONE
8((2E)2((2Z)2bromo3phenylprop2en1ylidene)hydrazinyl)6hydroxy7(2methoxyethyl)3methyl37dihydro2Hpurin2one
8((2E)2((Z)2bromo3phenylprop2enylidene)hydrazinyl)7(2methoxyethyl)3methylpurine26dione
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC(=CC3=CC=CC=C3)Br)CCOC
COCCn1c(NN=CC(=Cc2ccccc2)Br)nc2c1c(O)nc(=O)n2C
InChI=1SC18H19BrN6O3c1241514(16(26)2218(24)27)25(89282)17(2115)23201113(19)10126435712h371011H89H212H3(H2123)(H222627)b13102011+
MFCD18159805
ZINC000002275753
ZINC33926714
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