Vitas-M small molecule compound

2-(methylsulfanyl)ethyl 4-(3,4-dimethoxyphenyl)-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK701200
SMILES CSCCOC(=O)C1=C(C)NC(=O)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)24-7-8-25-4)15(19-17(21)18-10)11-5-6-12(22-2)13(9-11)23-3/h5-6,9,15H,7-8H2,1-4H3,(H2,18,19,21)
InChIKey
GCXASBMISPIZON-UHFFFAOYSA-N
Synonyms

2(methylsulfanyl)ethyl4(34dimethoxyphenyl)6methyl2oxo1234tetrahydropyrimidine5carboxylate
2METHYLSULFANYLETHYL4(34DIMETHOXYPHENYL)6METHYL2OXO34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
CC1=C(C(NC(=O)N1)C2=CC(=C(C=C2)OC)OC)C(=O)OCCSC
InChI=1SC17H22N2O5Sc11014(16(20)2478254)15(1917(21)1810)115612(222)13(911)233h56915H78H214H3(H2181921)
MFCD01192530
ZINC000004380846
ZINC000004380848

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Available files

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