Vitas-M small molecule compound
ethyl 4-amino-2-({2-[(5-chloro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Catalog ID
STL303096
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)Nc1cc(Cl)ccc1C
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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 C16H17ClN4O3S MW 380.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN4O3S/c1-3-24-15(23)11-7-19-16(21-14(11)18)25-8-13(22)20-12-6-10(17)5-4-9(12)2/h4-7H,3,8H2,1-2H3,(H,20,22)(H2,18,19,21)InChIKey
GMKLXDUWLUNNDT-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=C(C=CC(=C2)Cl)C
ethyl4amino2((2((5chloro2methylphenyl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ethyl4amino2(2(5chloro2methylanilino)2oxoethyl)sulfanylpyrimidine5carboxylate
InChI=1SC16H17ClN4O3Sc132415(23)1171916(2114(11)18)25813(22)2012610(17)549(12)2h47H38H212H3(H2022)(H2181921)
MFCD02573239
ZINC000000892294
ZINC00892294
ZINC892294
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