Vitas-M small molecule compound
(2E)-1-(1H-benzotriazol-1-yl)-3-(3,4-dimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK417536
SMILES COc1cc(/C=C/C(=O)n2nnc3c2cccc3)ccc1OC
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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 C17H15N3O3 MW 309.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N3O3/c1-22-15-9-7-12(11-16(15)23-2)8-10-17(21)20-14-6-4-3-5-13(14)18-19-20/h3-11H,1-2H3/b10-8+InChIKey
CJAPQGXCASLDLL-CSKARUKUSA-NSynonyms
(2E)1(1Hbenzotriazol1yl)3(34dimethoxyphenyl)prop2en1one
(2E)1BENZOTRIAZOLYL3(34DIMETHOXYPHENYL)PROP2EN1ONE
(E)1(BENZOTRIAZOL1YL)3(34DIMETHOXYPHENYL)PROP2EN1ONE
COC1=C(C=C(C=C1)C=CC(=O)N2C3=CC=CC=C3N=N2)OC
COc1cc(C=CC(=O)n2nnc3c2cccc3)ccc1OC
InChI=1SC17H15N3O3c122159712(1116(15)232)81017(21)2014643513(14)181920h311H12H3b108+
MFCD01336836
ZINC000005527258
ZINC05527258
ZINC5527258
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