Vitas-M small molecule compound
4-bromo-2-{(E)-[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl benzenesulfonate
Catalog ID
STK771631
SMILES Brc1ccc(c(c1)/C=C\1/N=C(OC1=O)c1ccc(cc1)C)OS(=O)(=O)c1ccccc1
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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 C23H16BrNO5S MW 498.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16BrNO5S/c1-15-7-9-16(10-8-15)22-25-20(23(26)29-22)14-17-13-18(24)11-12-21(17)30-31(27,28)19-5-3-2-4-6-19/h2-14H,1H3/b20-14+InChIKey
LCXXWCGWRXNOQK-XSFVSMFZSA-NSynonyms
(4BROMO2((E)(2(4METHYLPHENYL)5OXO13OXAZOL4YLIDENE)METHYL)PHENYL)BENZENESULFONATE
4bromo2((E)(2(4methylphenyl)5oxo13oxazol4(5H)ylidene)methyl)phenylbenzenesulfonate
Brc1ccc(c(c1)C=C1N=C(OC1=O)c1ccc(cc1)C)OS(=O)(=O)c1ccccc1
CC1=CC=C(C=C1)C2=NC(=CC3=C(C=CC(=C3)Br)OS(=O)(=O)C4=CC=CC=C4)C(=O)O2
InChI=1SC23H16BrNO5Sc1157916(10815)222520(23(26)2922)14171318(24)111221(17)3031(2728)195324619h214H1H3b2014+
MFCD02581258
ZINC000002980635
ZINC02980635
ZINC2980635
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