Vitas-M small molecule compound
(5E)-5-(3,5-dichloro-4-methoxybenzylidene)-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188071
SMILES COc1c(Cl)cc(cc1Cl)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
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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 C18H11Cl2FN2O3S MW 425.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11Cl2FN2O3S/c1-26-15-13(19)7-9(8-14(15)20)6-12-16(24)22-18(27)23(17(12)25)11-4-2-10(21)3-5-11/h2-8H,1H3,(H,22,24,27)/b12-6+InChIKey
WTIZLRFDGSORGI-WUXMJOGZSA-NSynonyms
(5E)5((35DICHLORO4METHOXYPHENYL)METHYLIDENE)1(4FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(35DICHLORO4METHOXYBENZYLIDENE)1(4FLUOROPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
COC1=C(C=C(C=C1Cl)C=C2C(=O)NC(=S)N(C2=O)C3=CC=C(C=C3)F)Cl
COc1c(Cl)cc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
InChI=1SC18H11Cl2FN2O3Sc1261513(19)79(814(15)20)61216(24)2218(27)23(17(12)25)114210(21)3511h28H1H3(H222427)b126+
MFCD03703795
ZINC000001199186
ZINC01199186
ZINC1199186
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