Vitas-M small molecule compound
ethyl 4-amino-2-({2-[(2-bromo-4,5-dimethylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Catalog ID
STL359709
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)Nc1cc(C)c(cc1Br)C
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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 C17H19BrN4O3S MW 439.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19BrN4O3S/c1-4-25-16(24)11-7-20-17(22-15(11)19)26-8-14(23)21-13-6-10(3)9(2)5-12(13)18/h5-7H,4,8H2,1-3H3,(H,21,23)(H2,19,20,22)InChIKey
BUEFZBCEIZBHNW-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=C(C=C(C(=C2)C)C)Br
ethyl4amino2((2((2bromo45dimethylphenyl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ETHYL4AMINO2(2(2BROMO45DIMETHYLANILINO)2OXOETHYL)SULFANYLPYRIMIDINE5CARBOXYLATE
InChI=1SC17H19BrN4O3Sc142516(24)1172017(2215(11)19)26814(23)2113610(3)9(2)512(13)18h57H48H213H3(H2123)(H2192022)
MFCD06626716
ZINC000002877185
ZINC02877185
ZINC2877185
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