Vitas-M small molecule compound
(5E)-5-[(5-iodofuran-2-yl)methylidene]-1-(prop-2-en-1-yl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188236
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(o2)I)/C1=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 C12H9IN2O3S MW 388.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9IN2O3S/c1-2-5-15-11(17)8(10(16)14-12(15)19)6-7-3-4-9(13)18-7/h2-4,6H,1,5H2,(H,14,16,19)/b8-6+InChIKey
QSDKBASFNOFBGM-SOFGYWHQSA-NSynonyms
(5E)5((5IODOFURAN2YL)METHYLIDENE)1(PROP2EN1YL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
(5E)5((5IODOFURAN2YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
C=CCN1C(=O)C(=CC2=CC=C(O2)I)C(=O)NC1=S
C=CCN1C(=S)NC(=O)C(=Cc2ccc(o2)I)C1=O
InChI=1SC12H9IN2O3Sc1251511(17)8(10(16)1412(15)19)67349(13)187h246H15H2(H141619)b86+
MFCD03065188
ZINC000001202245
ZINC01202245
ZINC1202245
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