Vitas-M small molecule compound
8-[(2Z)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-1,3-dimethyl-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK536410
SMILES C=CCn1c(N/N=C/2\C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C
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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 C18H16BrN7O3 MW 458.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16BrN7O3/c1-4-7-26-13-14(24(2)18(29)25(3)16(13)28)21-17(26)23-22-12-10-8-9(19)5-6-11(10)20-15(12)27/h4-6,8H,1,7H2,2-3H3,(H,21,23)(H,20,22,27)InChIKey
OPZVDPNDRCGKJZ-UHFFFAOYSA-NSynonyms
(Z)7allyl8(2(5bromo2oxoindolin3ylidene)hydrazinyl)13dimethyl1Hpurine26(3H7H)dione
8((2Z)2(5bromo2oxo12dihydro3Hindol3ylidene)hydrazinyl)13dimethyl7(prop2en1yl)37dihydro1Hpurine26dione
8(2(5BROMO2OXOINDOL3YL)HYDRAZINYL)13DIMETHYL7PROP2ENYLPURINE26DIONE
C=CCn1c(NN=C2C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NNC3=C4C=C(C=CC4=NC3=O)Br)CC=C
InChI=1SC18H16BrN7O3c147261314(24(2)18(29)25(3)16(13)28)2117(26)2322121089(19)5611(10)2015(12)27h468H17H223H3(H2123)(H202227)
MFCD02982998
ZINC000009057697
ZINC09057697
ZINC9057697
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