Vitas-M small molecule compound
ethyl 4-[({[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK117656
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)OCC)nc(=O)cc1N
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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 C18H20N4O4S MW 388.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O4S/c1-3-9-22-14(19)10-15(23)21-18(22)27-11-16(24)20-13-7-5-12(6-8-13)17(25)26-4-2/h3,5-8,10H,1,4,9,11,19H2,2H3,(H,20,24)InChIKey
OWACTENSYQLHRJ-UHFFFAOYSA-NSynonyms
694460-08-74(2(1ALLYL6AMINO4OXO14DIHYDROPYRIMIDIN2YLSULFANYL)ACETYLAMINO)BENZOICACIDETHYLESTER
694460087
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C=C(N2CC=C)N
ETHYL4((((6AMINO4OXO1(PROP2EN1YL)14DIHYDROPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2(6AMINO4OXO1PROP2ENYLPYRIMIDIN2YL)SULFANYLACETYL)AMINO)BENZOATE
InChI=1SC18H20N4O4Sc1392214(19)1015(23)2118(22)271116(24)20137512(6813)17(25)2642h35810H1491119H22H3(H2024)
MFCD02604905
ZINC000000806240
ZINC00806240
ZINC806240
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