Vitas-M small molecule compound

ethyl 4-(5-{(E)-[1-(4-fluorophenyl)-4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoate

Catalog ID
STK187459
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=O)NC(=S)N(C1=O)c1ccc(cc1)F

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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 C24H17FN2O5S MW 464.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H17FN2O5S/c1-2-31-23(30)15-5-3-14(4-6-15)20-12-11-18(32-20)13-19-21(28)26-24(33)27(22(19)29)17-9-7-16(25)8-10-17/h3-13H,2H2,1H3,(H,26,28,33)/b19-13+
InChIKey
WOCCUTZRSLOYMS-CPNJWEJPSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)C=C3C(=O)NC(=S)N(C3=O)C4=CC=C(C=C4)F
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C1C(=O)NC(=S)N(C1=O)c1ccc(cc1)F
ETHYL4(5((E)(1(4FLUOROPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)FURAN2YL)BENZOATE
ETHYL4(5((E)(1(4FLUOROPHENYL)46DIOXO2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)FURAN2YL)BENZOATE
InChI=1SC24H17FN2O5Sc123123(30)155314(4615)20121118(3220)131921(28)2624(33)27(22(19)29)179716(25)81017h313H2H21H3(H262833)b1913+
MFCD02308667
ZINC000001138326
ZINC01138326
ZINC1138326

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Available files

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