Vitas-M small molecule compound

ethyl (2-{(E)-[4,6-dioxo-1-(prop-2-en-1-yl)-2-thioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetate

Catalog ID
STK187403
SMILES C=CCN1C(=S)NC(=O)/C(=C\c2ccccc2OCC(=O)OCC)/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 C18H18N2O5S MW 374.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N2O5S/c1-3-9-20-17(23)13(16(22)19-18(20)26)10-12-7-5-6-8-14(12)25-11-15(21)24-4-2/h3,5-8,10H,1,4,9,11H2,2H3,(H,19,22,26)/b13-10+
InChIKey
FYCXXSRQGFGRAW-JLHYYAGUSA-N
Synonyms
433310-74-8
433310748
C=CCN1C(=S)NC(=O)C(=Cc2ccccc2OCC(=O)OCC)C1=O
CCOC(=O)COC1=CC=CC=C1C=C2C(=O)NC(=S)N(C2=O)CC=C
ETHYL(2((E)(46DIOXO1(PROP2EN1YL)2THIOXOTETRAHYDROPYRIMIDIN5(2H)YLIDENE)METHYL)PHENOXY)ACETATE
ETHYL2(2((E)(46DIOXO1PROP2ENYL2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETATE
InChI=1SC18H18N2O5Sc1392017(23)13(16(22)1918(20)26)1012756814(12)251115(21)2442h35810H14911H22H3(H192226)b1310+
MFCD03707134
ZINC000001153898
ZINC01153898
ZINC1153898

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Available files

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