Vitas-M small molecule compound
ethyl 4-amino-2-({2-[(3-bromophenyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Catalog ID
STL359711
SMILES CCOC(=O)c1cnc(nc1N)SCC(=O)Nc1cccc(c1)Br
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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 C15H15BrN4O3S MW 411.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN4O3S/c1-2-23-14(22)11-7-18-15(20-13(11)17)24-8-12(21)19-10-5-3-4-9(16)6-10/h3-7H,2,8H2,1H3,(H,19,21)(H2,17,18,20)InChIKey
NGGSIJVSYFIBBI-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=CC(=CC=C2)Br
ethyl4amino2((2((3bromophenyl)amino)2oxoethyl)sulfanyl)pyrimidine5carboxylate
ethyl4amino2(2(3bromoanilino)2oxoethyl)sulfanylpyrimidine5carboxylate
InChI=1SC15H15BrN4O3Sc122314(22)1171815(2013(11)17)24812(21)19105349(16)610h37H28H21H3(H1921)(H2171820)
MFCD07157235
ZINC000005969517
ZINC05969517
ZINC5969517
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