Vitas-M small molecule compound

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

Catalog ID
STK867988
SMILES COCCOC(=O)C1=C(C)NC(=S)NC1c1ccc(cc1)O

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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 C15H18N2O4S MW 322.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N2O4S/c1-9-12(14(19)21-8-7-20-2)13(17-15(22)16-9)10-3-5-11(18)6-4-10/h3-6,13,18H,7-8H2,1-2H3,(H2,16,17,22)
InChIKey
DAUAPNABIYGTLY-UHFFFAOYSA-N
Synonyms

2METHOXYETHYL4(4HYDROXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
2methoxyethyl4(4hydroxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)O)C(=O)OCCOC
InChI=1SC15H18N2O4Sc1912(14(19)2187202)13(1715(22)169)103511(18)6410h361318H78H212H3(H2161722)
MFCD01606037
ZINC000005051267
ZINC000005051274

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Available files

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