Vitas-M small molecule compound

ethyl 4-(4-methoxyphenyl)-6-phenyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STL506290
SMILES CCOC(=O)C1=C(NC(=S)NC1c1ccc(cc1)OC)c1ccccc1

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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 C20H20N2O3S MW 368.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O3S/c1-3-25-19(23)16-17(13-7-5-4-6-8-13)21-20(26)22-18(16)14-9-11-15(24-2)12-10-14/h4-12,18H,3H2,1-2H3,(H2,21,22,26)
InChIKey
DUVGSKAVFBGUSS-UHFFFAOYSA-N
Synonyms

2879750
ethyl4(4methoxyphenyl)6phenyl2sulfanylidene34dihydro1~(H)pyrimidine5carboxylate
ETHYL4(4METHOXYPHENYL)6PHENYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl4(4methoxyphenyl)6phenyl2thioxo1234tetrahydropyrimidine5carboxylate
ETHYL6(4METHOXYPHENYL)4PHENYL2THIOXO136TRIHYDROPYRIMIDINE5CARBOXYLATE
InChI=1SC20H20N2O3Sc132519(23)1617(137546813)2120(26)2218(16)1491115(242)121014h41218H3H212H3(H2212226)
MFCD00998740
ZINC000000726951
ZINC000100306344

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Available files

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