Vitas-M small molecule compound
ethyl 4-(3-bromo-4,5-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
Catalog ID
STK957723
SMILES CCOC(=O)C1=C(C)NC(=S)NC1c1cc(Br)c(c(c1)OC)OC
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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 C16H19BrN2O4S MW 415.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19BrN2O4S/c1-5-23-15(20)12-8(2)18-16(24)19-13(12)9-6-10(17)14(22-4)11(7-9)21-3/h6-7,13H,5H2,1-4H3,(H2,18,19,24)InChIKey
KRBNEVAFFKKXBB-UHFFFAOYSA-NSynonyms
445250-24-8445250248
CCOC(=O)C1=C(NC(=S)NC1C2=CC(=C(C(=C2)Br)OC)OC)C
ETHYL4(3BROMO45DIMETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl4(3bromo45dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC16H19BrN2O4Sc152315(20)128(2)1816(24)1913(12)9610(17)14(224)11(79)213h6713H5H214H3(H2181924)
MFCD01919468
ZINC000000997823
ZINC000000997824
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