Vitas-M small molecule compound
ethyl 4-{[3-(acetylamino)phenyl]amino}-2-(methylsulfanyl)pyrimidine-5-carboxylate
Catalog ID
STL185987
SMILES CCOC(=O)c1cnc(nc1Nc1cccc(c1)NC(=O)C)SC
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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 C16H18N4O3S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O3S/c1-4-23-15(22)13-9-17-16(24-3)20-14(13)19-12-7-5-6-11(8-12)18-10(2)21/h5-9H,4H2,1-3H3,(H,18,21)(H,17,19,20)InChIKey
ADKFDXXEVHGSTN-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1NC2=CC(=CC=C2)NC(=O)C)SC
ethyl4((3(acetylamino)phenyl)amino)2(methylsulfanyl)pyrimidine5carboxylate
ETHYL4((3(ACETYLAMINO)PHENYL)AMINO)2METHYLTHIOPYRIMIDINE5CARBOXYLATE
ethyl4(3acetamidoanilino)2methylsulfanylpyrimidine5carboxylate
InChI=1SC16H18N4O3Sc142315(22)1391716(243)2014(13)191275611(812)1810(2)21h59H4H213H3(H1821)(H171920)
MFCD09058070
ZINC000011907874
ZINC11907874
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