Vitas-M small molecule compound
2-(3-bromo-4-methoxyphenyl)-2-oxoethyl 2H-benzotriazol-2-ylacetate
Catalog ID
STK044288
SMILES COc1ccc(cc1Br)C(=O)COC(=O)Cn1nc2c(n1)cccc2
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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 C17H14BrN3O4 MW 404.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14BrN3O4/c1-24-16-7-6-11(8-12(16)18)15(22)10-25-17(23)9-21-19-13-4-2-3-5-14(13)20-21/h2-8H,9-10H2,1H3InChIKey
LJCKVMPEYQQQSO-UHFFFAOYSA-NSynonyms
(2(3BROMO4METHOXYPHENYL)2OXOETHYL)2(BENZOTRIAZOL2YL)ACETATE
2(3BROMO4METHOXYPHENYL)2OXOETHYL2HBENZOTRIAZOL2YLACETATE
COC1=C(C=C(C=C1)C(=O)COC(=O)CN2N=C3C=CC=CC3=N2)Br
COc1ccc(cc1Br)C(=O)COC(=O)Cn1nc2c(n1)cccc2
InChI=1SC17H14BrN3O4c124167611(812(16)18)15(22)102517(23)9211913423514(13)2021h28H910H21H3
MFCD02018677
STK044288
ZINC000005917926
ZINC05917926
ZINC5917926
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