Vitas-M small molecule compound
(5E)-5-[4-(butan-2-yloxy)-3-chlorobenzylidene]-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK013639
SMILES CCC(Oc1ccc(cc1Cl)/C=C/1\C(=O)NC(=S)N(C1=O)C)C
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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 C16H17ClN2O3S MW 352.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN2O3S/c1-4-9(2)22-13-6-5-10(8-12(13)17)7-11-14(20)18-16(23)19(3)15(11)21/h5-9H,4H2,1-3H3,(H,18,20,23)/b11-7+InChIKey
YUWIAYDPDLGEEI-YRNVUSSQSA-NSynonyms
(5E)5((4BUTAN2YLOXY3CHLOROPHENYL)METHYLIDENE)1METHYL2SULFANYLIDENE13DIAZINANE46DIONE
(5E)5(4(BUTAN2YLOXY)3CHLOROBENZYLIDENE)1METHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
5(4SECBUTOXY3CHLOROBENZYLIDENE)1METHYL2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
CCC(C)OC1=C(C=C(C=C1)C=C2C(=O)NC(=S)N(C2=O)C)Cl
CCC(Oc1ccc(cc1Cl)C=C1C(=O)NC(=S)N(C1=O)C)C
InChI=1SC16H17ClN2O3Sc149(2)22136510(812(13)17)71114(20)1816(23)19(3)15(11)21h59H4H213H3(H182023)b117+
MFCD03269954
STK013639
ZINC000000981056
ZINC000000981058
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