Vitas-M small molecule compound
2,4-dibromo-6-[(E)-{2-[(2-bromo-4-nitrophenoxy)acetyl]hydrazinylidene}methyl]phenyl 3-methylbenzoate
Catalog ID
STK671810
SMILES O=C(COc1ccc(cc1Br)[N+](=O)[O-])N/N=C/c1cc(Br)cc(c1OC(=O)c1cccc(c1)C)Br
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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 C23H16Br3N3O6 MW 670.11 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16Br3N3O6/c1-13-3-2-4-14(7-13)23(31)35-22-15(8-16(24)9-19(22)26)11-27-28-21(30)12-34-20-6-5-17(29(32)33)10-18(20)25/h2-11H,12H2,1H3,(H,28,30)/b27-11+InChIKey
DETCOXCEXSNHRM-LUOAPIJWSA-NSynonyms
(24dibromo6((E)((2(2bromo4nitrophenoxy)acetyl)hydrazinylidene)methyl)phenyl)3methylbenzoate
24DIBROMO6((E)(2((2BROMO4NITROPHENOXY)ACETYL)HYDRAZINYLIDENE)METHYL)PHENYL3METHYLBENZOATE
CC1=CC=CC(=C1)C(=O)OC2=C(C=C(C=C2C=NNC(=O)COC3=C(C=C(C=C3)(N+)(=O)(O))Br)Br)Br
InChI=1SC23H16Br3N3O6c11332414(713)23(31)352215(816(24)919(22)26)11272821(30)1234206517(29(32)33)1018(20)25h211H12H21H3(H2830)b2711+
MFCD00821181
O=C(COc1ccc(cc1Br)(N+)(=O)(O))NN=Cc1cc(Br)cc(c1OC(=O)c1cccc(c1)C)Br
ZINC000098001651
ZINC150592952
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