Vitas-M small molecule compound
2-[(2E)-2-{3-bromo-5-methoxy-4-[(4-nitrobenzyl)oxy]benzylidene}hydrazinyl]-1H-benzimidazole
Catalog ID
STK258967
SMILES COc1cc(/C=N/Nc2nc3c([nH]2)cccc3)cc(c1OCc1ccc(cc1)[N+](=O)[O-])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 C22H18BrN5O4 MW 496.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN5O4/c1-31-20-11-15(12-24-27-22-25-18-4-2-3-5-19(18)26-22)10-17(23)21(20)32-13-14-6-8-16(9-7-14)28(29)30/h2-12H,13H2,1H3,(H2,25,26,27)/b24-12+InChIKey
RRVUXRMANIALSL-WYMPLXKRSA-NSynonyms
((1E)2(3BROMO5METHOXY4((4NITROPHENYL)METHOXY)PHENYL)1AZAVINYL)BENZIMIDAZOL2YLAMINE
2((2E)2(3bromo5methoxy4((4nitrobenzyl)oxy)benzylidene)hydrazinyl)1Hbenzimidazole
COC1=C(C(=CC(=C1)C=NNC2=NC3=CC=CC=C3N2)Br)OCC4=CC=C(C=C4)(N+)(=O)(O)
COc1cc(C=NNc2nc3c((nH)2)cccc3)cc(c1OCc1ccc(cc1)(N+)(=O)(O))Br
InChI=1SC22H18BrN5O4c131201115(122427222518423519(18)2622)1017(23)21(20)3213146816(9714)28(29)30h212H13H21H3(H2252627)b2412+
MFCD03103088
N((E)(3bromo5methoxy4((4nitrophenyl)methoxy)phenyl)methylideneamino)1Hbenzimidazol2amine
ZINC000004113141
ZINC38194767
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