Vitas-M small molecule compound
(2-bromo-4-{(Z)-[1-(4-hydroxyphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL484718
SMILES OC(=O)COc1ccc(cc1Br)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
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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 C19H13BrN2O7 MW 461.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13BrN2O7/c20-14-8-10(1-6-15(14)29-9-16(24)25)7-13-17(26)21-19(28)22(18(13)27)11-2-4-12(23)5-3-11/h1-8,23H,9H2,(H,24,25)(H,21,26,28)/b13-7-InChIKey
RBQNQJQTKKRYCK-QPEQYQDCSA-NSynonyms
(2bromo4((Z)(1(4hydroxyphenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(2bromo4((Z)(1(4hydroxyphenyl)246trioxo13diazinan5ylidene)methyl)phenoxy)aceticacid
C1=CC(=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Br)C(=O)NC2=O)O
InChI=1SC19H13BrN2O7c2014810(1615(14)29916(24)25)71317(26)2119(28)22(18(13)27)112412(23)5311h1823H9H2(H2425)(H212628)b137
MFCD30713668
OC(=O)COc1ccc(cc1Br)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)O
ZINC000033306873
ZINC33306873
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