Vitas-M small molecule compound
(4-{(Z)-[1-(2-fluorophenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}phenoxy)acetic acid
Catalog ID
STL044391
SMILES OC(=O)COc1ccc(cc1)/C=C\1/C(=O)N=C(N(C1=O)c1ccccc1F)S
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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 C19H13FN2O5S MW 400.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13FN2O5S/c20-14-3-1-2-4-15(14)22-18(26)13(17(25)21-19(22)28)9-11-5-7-12(8-6-11)27-10-16(23)24/h1-9H,10H2,(H,23,24)(H,21,25,28)/b13-9-InChIKey
MAXYHOOEPSAQBC-LCYFTJDESA-NSynonyms
(4((Z)(1(2fluorophenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)phenoxy)aceticacid
2(4((Z)(1(2FLUOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
InChI=1SC19H13FN2O5Sc2014312415(14)2218(26)13(17(25)2119(22)28)9115712(8611)271016(23)24h19H10H2(H2324)(H212528)b139
MFCD03803552
OC(=O)COc1ccc(cc1)C=C1C(=O)N=C(N(C1=O)c1ccccc1F)S
ZINC000009008180
ZINC9008180
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