Vitas-M small molecule compound

2-(4-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)-N-(4-fluorophenyl)acetamide

Catalog ID
STK187401
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccc(c(c2)OC)OCC(=O)Nc2ccc(cc2)F)/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 C23H20FN3O5S MW 469.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20FN3O5S/c1-3-10-27-22(30)17(21(29)26-23(27)33)11-14-4-9-18(19(12-14)31-2)32-13-20(28)25-16-7-5-15(24)6-8-16/h3-9,11-12H,1,10,13H2,2H3,(H,25,28)(H,26,29,33)/b17-11+
InChIKey
HAWGQWCSIUZBCQ-GZTJUZNOSA-N
Synonyms

2(4((E)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)2METHOXYPHENOXY)N(4FLUOROPHENYL)ACETAMIDE
2(4((E)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)N(4FLUOROPHENYL)ACETAMIDE
C=CCN1C(=S)NC(=O)C(=Cc2ccc(c(c2)OC)OCC(=O)Nc2ccc(cc2)F)C1=O
COC1=C(C=CC(=C1)C=C2C(=O)NC(=S)N(C2=O)CC=C)OCC(=O)NC3=CC=C(C=C3)F
InChI=1SC23H20FN3O5Sc13102722(30)17(21(29)2623(27)33)11144918(19(1214)312)321320(28)25167515(24)6816h391112H11013H22H3(H2528)(H262933)b1711+
MFCD03707042
ZINC000001153311
ZINC01153311
ZINC1153311

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Available files

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