Vitas-M small molecule compound
(2-bromo-4-{(E)-[1-(4-chlorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK010826
SMILES OC(=O)COc1ccc(cc1Br)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl
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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 C19H12BrClN2O5S MW 495.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12BrClN2O5S/c20-14-8-10(1-6-15(14)28-9-16(24)25)7-13-17(26)22-19(29)23(18(13)27)12-4-2-11(21)3-5-12/h1-8H,9H2,(H,24,25)(H,22,26,29)/b13-7+InChIKey
GHNYOVLNKHOFER-NTUHNPAUSA-NSynonyms
(2BROMO4((E)(1(4CHLOROPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETICACID
2(2bromo4((1(4chlorophenyl)46dioxo2thioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(2BROMO4((E)(1(4CHLOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
C1=CC(=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OCC(=O)O)Br)C(=O)NC2=S)Cl
InChI=1SC19H12BrClN2O5Sc2014810(1615(14)28916(24)25)71317(26)2219(29)23(18(13)27)124211(21)3512h18H9H2(H2425)(H222629)b137+
MFCD02084972
OC(=O)COc1ccc(cc1Br)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Cl
STK010826
ZINC000002261364
ZINC2261364
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