Vitas-M small molecule compound
(2,6-dichloro-4-{(E)-[1-(4-methylphenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STK176978
SMILES OC(=O)COc1c(Cl)cc(cc1Cl)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
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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 C20H14Cl2N2O6 MW 449.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14Cl2N2O6/c1-10-2-4-12(5-3-10)24-19(28)13(18(27)23-20(24)29)6-11-7-14(21)17(15(22)8-11)30-9-16(25)26/h2-8H,9H2,1H3,(H,25,26)(H,23,27,29)/b13-6+InChIKey
OYMCNKQDRIPCQD-AWNIVKPZSA-NSynonyms
(26DICHLORO4((E)(1(4METHYLPHENYL)246TRIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETICACID
2(26DICHLORO4((E)(1(4METHYLPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
CC1=CC=C(C=C1)N2C(=O)C(=CC3=CC(=C(C(=C3)Cl)OCC(=O)O)Cl)C(=O)NC2=O
InChI=1SC20H14Cl2N2O6c1102412(5310)2419(28)13(18(27)2320(24)29)611714(21)17(15(22)811)30916(25)26h28H9H21H3(H2526)(H232729)b136+
MFCD02085089
OC(=O)COc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=O)N(C1=O)c1ccc(cc1)C
ZINC000002903963
ZINC2903963
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