Vitas-M small molecule compound

2-methoxyethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK812690
SMILES COCCOC(=O)C1=C(C)NC(=S)NC1c1ccc(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 C17H22N2O5S MW 366.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N2O5S/c1-10-14(16(20)24-8-7-21-2)15(19-17(25)18-10)11-5-6-12(22-3)13(9-11)23-4/h5-6,9,15H,7-8H2,1-4H3,(H2,18,19,25)
InChIKey
BZROTULWFVJFJM-UHFFFAOYSA-N
Synonyms

2METHOXYETHYL4(34DIMETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2methoxyethyl4(34dimethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
CC1=C(C(NC(=S)N1)C2=CC(=C(C=C2)OC)OC)C(=O)OCCOC
InChI=1SC17H22N2O5Sc11014(16(20)2487212)15(1917(25)1810)115612(223)13(911)234h56915H78H214H3(H2181925)
MFCD01606075
ZINC000004906998
ZINC000004907001

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.