Vitas-M small molecule compound
ethyl 4-[({[4-methyl-6-oxo-5-(prop-2-en-1-yl)-1,6-dihydropyrimidin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STK113024
SMILES C=CCc1c(C)nc([nH]c1=O)SCC(=O)Nc1ccc(cc1)C(=O)OCC
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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 C19H21N3O4S MW 387.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21N3O4S/c1-4-6-15-12(3)20-19(22-17(15)24)27-11-16(23)21-14-9-7-13(8-10-14)18(25)26-5-2/h4,7-10H,1,5-6,11H2,2-3H3,(H,21,23)(H,20,22,24)InChIKey
WIXFYIIXETZVEA-UHFFFAOYSA-NSynonyms
C=CCc1c(C)nc((nH)c1=O)SCC(=O)Nc1ccc(cc1)C(=O)OCC
CCOC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2)C)CC=C
ETHYL4((((4METHYL6OXO5(PROP2EN1YL)16DIHYDROPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
ETHYL4((2((6METHYL4OXO5PROP2ENYL1HPYRIMIDIN2YL)SULFANYL)ACETYL)AMINO)BENZOATE
InChI=1SC19H21N3O4Sc1461512(3)2019(2217(15)24)271116(23)21149713(81014)18(25)2652h4710H15611H223H3(H2123)(H202224)
MFCD03778959
ZINC000002368187
ZINC02368187
ZINC2368187
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