Vitas-M small molecule compound
(5Z)-5-{4-[(3,4-dichlorobenzyl)oxy]-3-iodobenzylidene}-1-(4-fluorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK190038
SMILES Fc1ccc(cc1)N1C(=S)NC(=O)/C(=C/c2ccc(c(c2)I)OCc2ccc(c(c2)Cl)Cl)/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 C24H14Cl2FIN2O3S MW 627.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H14Cl2FIN2O3S/c25-18-7-1-14(10-19(18)26)12-33-21-8-2-13(11-20(21)28)9-17-22(31)29-24(34)30(23(17)32)16-5-3-15(27)4-6-16/h1-11H,12H2,(H,29,31,34)/b17-9-InChIKey
PVTLXHJOZYATEG-MFOYZWKCSA-NSynonyms
(5Z)5((4((34dichlorophenyl)methoxy)3iodophenyl)methylidene)1(4fluorophenyl)2sulfanylidene13diazinane46dione
(5Z)5(4((34DICHLOROBENZYL)OXY)3IODOBENZYLIDENE)1(4FLUOROPHENYL)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC(=CC=C1N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC(=C(C=C4)Cl)Cl)I)C(=O)NC2=S)F
Fc1ccc(cc1)N1C(=S)NC(=O)C(=Cc2ccc(c(c2)I)OCc2ccc(c(c2)Cl)Cl)C1=O
InChI=1SC24H14Cl2FIN2O3Sc25187114(1019(18)26)1233218213(1120(21)28)91722(31)2924(34)30(23(17)32)165315(27)4616h111H12H2(H293134)b179
MFCD03226944
ZINC000097960960
ZINC97960960
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