Vitas-M small molecule compound

ethyl 4-(2-ethoxyphenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK107554
SMILES CCOC(=O)C1=C(C)NC(=S)NC1c1ccccc1OCC

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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 C16H20N2O3S MW 320.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O3S/c1-4-20-12-9-7-6-8-11(12)14-13(15(19)21-5-2)10(3)17-16(22)18-14/h6-9,14H,4-5H2,1-3H3,(H2,17,18,22)
InChIKey
ZFUPGZFOCOQJNF-UHFFFAOYSA-N
Synonyms
295344-56-8
295344568
CCOC1=CC=CC=C1C2C(=C(NC(=S)N2)C)C(=O)OCC
ETHYL4(2ETHOXYPHENYL)6METHYL2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl4(2ethoxyphenyl)6methyl2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC16H20N2O3Sc142012976811(12)1413(15(19)2152)10(3)1716(22)1814h6914H45H213H3(H2171822)
MFCD00404758
ZINC000000194835
ZINC000000194837

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Available files

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