Vitas-M small molecule compound
(5E)-5-(5-chloro-2-methoxybenzylidene)-1-(2-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL378438
SMILES COc1ccc(cc1/C=C/1\C(=O)NC(=S)N(C1=O)c1ccccc1F)Cl
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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 C18H12ClFN2O3S MW 390.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H12ClFN2O3S/c1-25-15-7-6-11(19)8-10(15)9-12-16(23)21-18(26)22(17(12)24)14-5-3-2-4-13(14)20/h2-9H,1H3,(H,21,23,26)/b12-9+InChIKey
AAOOLOGAEUHLHP-FMIVXFBMSA-NSynonyms
(5E)5((5CHLORO2METHOXYPHENYL)METHYLIDENE)1(2FLUOROPHENYL)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(5chloro2methoxybenzylidene)1(2fluorophenyl)2thioxodihydropyrimidine46(1H5H)dione
COC1=C(C=C(C=C1)Cl)C=C2C(=O)NC(=S)N(C2=O)C3=CC=CC=C3F
COc1ccc(cc1C=C1C(=O)NC(=S)N(C1=O)c1ccccc1F)Cl
InChI=1SC18H12ClFN2O3Sc125157611(19)810(15)91216(23)2118(26)22(17(12)24)14532413(14)20h29H1H3(H212326)b129+
MFCD02637321
ZINC000001407300
ZINC01407300
ZINC1407300
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