Vitas-M small molecule compound
5-[3-iodo-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STL505011
SMILES C#CCOc1c(I)cc(cc1OC)C=C1C(=O)NC(=S)NC1=O
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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 C15H11IN2O4S MW 442.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H11IN2O4S/c1-3-4-22-12-10(16)6-8(7-11(12)21-2)5-9-13(19)17-15(23)18-14(9)20/h1,5-7H,4H2,2H3,(H2,17,18,19,20,23)InChIKey
KEEJSKXZMOCNQU-UHFFFAOYSA-NSynonyms
4589895
5((3IODO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
5(3iodo5methoxy4(prop2yn1yloxy)benzylidene)2thioxodihydropyrimidine46(1H5H)dione
InChI=1SC15H11IN2O4Sc134221210(16)68(711(12)212)5913(19)1715(23)1814(9)20h157H4H22H3(H21718192023)
MFCD04083492
ZINC000019635286
ZINC19635286
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