Vitas-M small molecule compound
5-[3-ethoxy-5-iodo-4-(prop-2-yn-1-yloxy)benzylidene]-1,3-dimethyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK188167
SMILES C#CCOc1c(I)cc(cc1OCC)C=C1C(=O)N(C)C(=S)N(C1=O)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 C18H17IN2O4S MW 484.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17IN2O4S/c1-5-7-25-15-13(19)9-11(10-14(15)24-6-2)8-12-16(22)20(3)18(26)21(4)17(12)23/h1,8-10H,6-7H2,2-4H3InChIKey
MNEJNVRRUICAQU-UHFFFAOYSA-NSynonyms
347387-15-9347387159
5((3ETHOXY5IODO4PROP2YNOXYPHENYL)METHYLIDENE)13DIMETHYL2SULFANYLIDENE13DIAZINANE46DIONE
5(3ETHOXY5IODO4(2PROPYNYLOXY)BENZYLIDENE)13DIMETHYL2THIOXODIHYDRO46(1H5H)PYRIMIDINEDIONE
5(3ETHOXY5IODO4(PROP2YN1YLOXY)BENZYLIDENE)13DIMETHYL2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCOC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N(C2=O)C)C)I)OCC#C
InChI=1SC18H17IN2O4Sc157251513(19)911(1014(15)2462)81216(22)20(3)18(26)21(4)17(12)23h1810H67H224H3
MFCD02624240
ZINC000002076381
ZINC02076381
ZINC2076381
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