Vitas-M small molecule compound
(5E)-5-(3-bromo-5-ethoxy-4-hydroxybenzylidene)-1-(3-bromophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK330688
SMILES CCOc1cc(/C=C/2\C(=O)NC(=S)N(C2=O)c2cccc(c2)Br)cc(c1O)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 C19H14Br2N2O4S MW 526.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14Br2N2O4S/c1-2-27-15-8-10(7-14(21)16(15)24)6-13-17(25)22-19(28)23(18(13)26)12-5-3-4-11(20)9-12/h3-9,24H,2H2,1H3,(H,22,25,28)/b13-6+InChIKey
PEADJGCRJIHLFC-AWNIVKPZSA-NSynonyms
(5E)5((3bromo5ethoxy4hydroxyphenyl)methylidene)1(3bromophenyl)2sulfanylidene13diazinane46dione
(5E)5(3bromo5ethoxy4hydroxybenzylidene)1(3bromophenyl)2thioxodihydropyrimidine46(1H5H)dione
CCOC1=C(C(=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)C3=CC(=CC=C3)Br)Br)O
CCOc1cc(C=C2C(=O)NC(=S)N(C2=O)c2cccc(c2)Br)cc(c1O)Br
InChI=1SC19H14Br2N2O4Sc122715810(714(21)16(15)24)61317(25)2219(28)23(18(13)26)1253411(20)912h3924H2H21H3(H222528)b136+
MFCD03175553
ZINC000097962627
ZINC97962627
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