Vitas-M small molecule compound
8-{(2E)-2-[(2Z)-2-bromo-3-phenylprop-2-en-1-ylidene]hydrazinyl}-3-methyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK833946
SMILES C=CCn1c(N/N=C/C(=C/c2ccccc2)/Br)nc2c1c(=O)[nH]c(=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 C18H17BrN6O2 MW 429.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN6O2/c1-3-9-25-14-15(24(2)18(27)22-16(14)26)21-17(25)23-20-11-13(19)10-12-7-5-4-6-8-12/h3-8,10-11H,1,9H2,2H3,(H,21,23)(H,22,26,27)/b13-10-,20-11+InChIKey
SVRXTEDFYJZKGN-ULCUFOFXSA-NSynonyms
331658-94-7331658947
7allyl8((E)2((Z)2bromo3phenylallylidene)hydrazinyl)3methyl1Hpurine26(3H7H)dione
8(((3Z1E)3BROMO4PHENYL1AZABUTA13DIENYL)AMINO)3METHYL7PROP2ENYL137TRIHYDROPURINE26DIONE
8((2E)2((2Z)2bromo3phenylprop2en1ylidene)hydrazinyl)3methyl7(prop2en1yl)37dihydro1Hpurine26dione
8((2E)2((Z)2bromo3phenylprop2enylidene)hydrazinyl)3methyl7prop2enylpurine26dione
C=CCn1c(NN=CC(=Cc2ccccc2)Br)nc2c1c(=O)(nH)c(=O)n2C
CN1C2=C(C(=O)NC1=O)N(C(=N2)NN=CC(=CC3=CC=CC=C3)Br)CC=C
InChI=1SC18H17BrN6O2c139251415(24(2)18(27)2216(14)26)2117(25)23201113(19)10127546812h381011H19H22H3(H2123)(H222627)b13102011+
MFCD00620739
ZINC000000823873
ZINC33340975
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