Vitas-M small molecule compound
ethyl 6-(3-bromophenyl)-4-methyl-2-sulfanyl-1,6-dihydropyrimidine-5-carboxylate
Catalog ID
STK805249
SMILES CCOC(=O)C1=C(C)N=C(NC1c1cccc(c1)Br)S
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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 C14H15BrN2O2S MW 355.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrN2O2S/c1-3-19-13(18)11-8(2)16-14(20)17-12(11)9-5-4-6-10(15)7-9/h4-7,12H,3H2,1-2H3,(H2,16,17,20)InChIKey
REPDOYBEWNSOAO-UHFFFAOYSA-NSynonyms
294854-53-8CCOC(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)Br)C
ETHYL4(3BROMOPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl6(3bromophenyl)4methyl2sulfanyl16dihydropyrimidine5carboxylate
ETHYL6(3BROMOPHENYL)4METHYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC14H15BrN2O2Sc131913(18)118(2)1614(20)1712(11)954610(15)79h4712H3H212H3(H2161720)
MFCD02169960
ZINC000000756588
ZINC000017724707
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