Vitas-M small molecule compound
{2-bromo-4-[(1,3-dimethyl-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene)methyl]-6-methoxyphenoxy}acetic acid
Catalog ID
STL369995
SMILES COc1cc(C=C2C(=O)N(C)C(=O)N(C2=O)C)cc(c1OCC(=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 C16H15BrN2O7 MW 427.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15BrN2O7/c1-18-14(22)9(15(23)19(2)16(18)24)4-8-5-10(17)13(11(6-8)25-3)26-7-12(20)21/h4-6H,7H2,1-3H3,(H,20,21)InChIKey
XRCWEMXKRLFLPD-UHFFFAOYSA-NSynonyms
(2bromo4((13dimethyl246trioxotetrahydropyrimidin5(2H)ylidene)methyl)6methoxyphenoxy)aceticacid
2(2BROMO4((13DIMETHYL246TRIOXO13DIAZINAN5YLIDENE)METHYL)6METHOXYPHENOXY)ACETICACID
CN1C(=O)C(=CC2=CC(=C(C(=C2)Br)OCC(=O)O)OC)C(=O)N(C1=O)C
InChI=1SC16H15BrN2O7c11814(22)9(15(23)19(2)16(18)24)48510(17)13(11(68)253)26712(20)21h46H7H213H3(H2021)
MFCD01784439
ZINC000009234520
ZINC9234520
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