Vitas-M small molecule compound
methyl (4-{(Z)-[1-(4-bromophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetate
Catalog ID
STK192685
SMILES COC(=O)COc1ccc(cc1)/C=C\1/C(=O)NC(=S)N(C1=O)c1ccc(cc1)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 C20H15BrN2O5S MW 475.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrN2O5S/c1-27-17(24)11-28-15-8-2-12(3-9-15)10-16-18(25)22-20(29)23(19(16)26)14-6-4-13(21)5-7-14/h2-10H,11H2,1H3,(H,22,25,29)/b16-10-InChIKey
BRPACPJMUUNKFG-YBEGLDIGSA-NSynonyms
COC(=O)COC1=CC=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)Br
COC(=O)COc1ccc(cc1)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)Br
InChI=1SC20H15BrN2O5Sc12717(24)1128158212(3915)101618(25)2220(29)23(19(16)26)146413(21)5714h210H11H21H3(H222529)b1610
METHYL(4((Z)(1(4BROMOPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETATE
METHYL2(4((Z)(1(4BROMOPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETATE
MFCD04479520
ZINC000001176625
ZINC01176625
ZINC1176625
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