Vitas-M small molecule compound
8-[(2E)-2-(5-bromo-2-oxo-1,2-dihydro-3H-indol-3-ylidene)hydrazinyl]-7-ethyl-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840430
SMILES 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 C17H16BrN7O3 MW 446.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16BrN7O3/c1-4-25-12-13(23(2)17(28)24(3)15(12)27)20-16(25)22-21-11-9-7-8(18)5-6-10(9)19-14(11)26/h5-7H,4H2,1-3H3,(H,20,22)(H,19,21,26)InChIKey
QJCVGRKDPXXBTL-UHFFFAOYSA-NSynonyms
(E)8(2(5bromo2oxoindolin3ylidene)hydrazinyl)7ethyl13dimethyl1Hpurine26(3H7H)dione
(Z)8(2(5BROMO2OXOINDOLIN3YLIDENE)HYDRAZINYL)7ETHYL13DIMETHYL1HPURINE26(3H7H)DIONE
8((2E)2(5bromo2oxo12dihydro3Hindol3ylidene)hydrazinyl)7ethyl13dimethyl37dihydro1Hpurine26dione
8(2(5BROMO2OXOINDOL3YL)HYDRAZINYL)7ETHYL13DIMETHYLPURINE26DIONE
CCn1c(NN=C2C(=O)Nc3c2cc(Br)cc3)nc2c1c(=O)n(c(=O)n2C)C
CCN1C2=C(N=C1NNC3=C4C=C(C=CC4=NC3=O)Br)N(C(=O)N(C2=O)C)C
InChI=1SC17H16BrN7O3c14251213(23(2)17(28)24(3)15(12)27)2016(25)222111978(18)5610(9)1914(11)26h57H4H213H3(H2022)(H192126)
MFCD02241056
ZINC000009404911
ZINC09404911
ZINC9404911
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