Vitas-M small molecule compound
5-{[4-(benzyloxy)-3-bromo-5-methoxybenzyl]amino}-1,3-dihydro-2H-benzimidazol-2-one
Catalog ID
STK511630
SMILES COc1cc(CNc2ccc3c(c2)[nH]c(=O)[nH]3)cc(c1OCc1ccccc1)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 C22H20BrN3O3 MW 454.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrN3O3/c1-28-20-10-15(9-17(23)21(20)29-13-14-5-3-2-4-6-14)12-24-16-7-8-18-19(11-16)26-22(27)25-18/h2-11,24H,12-13H2,1H3,(H2,25,26,27)InChIKey
AGYJJFXYXGVAJW-UHFFFAOYSA-NSynonyms
5(((3BROMO5METHOXY4(PHENYLMETHOXY)PHENYL)METHYL)AMINO)3HYDROBENZIMIDAZOL2ONE
5((3BROMO5METHOXY4PHENYLMETHOXYPHENYL)METHYLAMINO)13DIHYDROBENZIMIDAZOL2ONE
5((4(benzyloxy)3bromo5methoxybenzyl)amino)13dihydro2Hbenzimidazol2one
COC1=C(C(=CC(=C1)CNC2=CC3=C(C=C2)NC(=O)N3)Br)OCC4=CC=CC=C4
COc1cc(CNc2ccc3c(c2)(nH)c(=O)(nH)3)cc(c1OCc1ccccc1)Br
InChI=1SC22H20BrN3O3c128201015(917(23)21(20)2913145324614)122416781819(1116)2622(27)2518h21124H1213H21H3(H2252627)
MFCD02316333
ZINC000013532856
ZINC13532856
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