Vitas-M small molecule compound
ethyl 4-[(2-{[6-amino-4-oxo-1-(prop-2-en-1-yl)-1,4-dihydropyrimidin-2-yl]sulfanyl}butanoyl)amino]benzoate
Catalog ID
STK289647
SMILES C=CCn1c(nc(=O)cc1N)SC(C(=O)Nc1ccc(cc1)C(=O)OCC)CC
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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 C20H24N4O4S MW 416.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O4S/c1-4-11-24-16(21)12-17(25)23-20(24)29-15(5-2)18(26)22-14-9-7-13(8-10-14)19(27)28-6-3/h4,7-10,12,15H,1,5-6,11,21H2,2-3H3,(H,22,26)InChIKey
URNZIFIELBCSOM-UHFFFAOYSA-NSynonyms
CCC(C(=O)NC1=CC=C(C=C1)C(=O)OCC)SC2=NC(=O)C=C(N2CC=C)N
ETHYL4((2((6AMINO4OXO1(PROP2EN1YL)14DIHYDROPYRIMIDIN2YL)SULFANYL)BUTANOYL)AMINO)BENZOATE
ETHYL4(2(6AMINO4OXO1PROP2ENYLPYRIMIDIN2YL)SULFANYLBUTANOYLAMINO)BENZOATE
InChI=1SC20H24N4O4Sc14112416(21)1217(25)2320(24)2915(52)18(26)22149713(81014)19(27)2863h47101215H1561121H223H3(H2226)
MFCD09960259
ZINC000006223952
ZINC000006224511
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