Vitas-M small molecule compound

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

Catalog ID
STK728802
SMILES CCOC(=O)C1=C(NC(=S)NC1c1cccs1)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 C17H16N2O2S2 MW 344.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O2S2/c1-2-21-16(20)13-14(11-7-4-3-5-8-11)18-17(22)19-15(13)12-9-6-10-23-12/h3-10,15H,2H2,1H3,(H2,18,19,22)
InChIKey
RQMQTNNRECPUSJ-UHFFFAOYSA-N
Synonyms
292878-60-5
292878605
CCOC(=O)C1=C(NC(=S)NC1C2=CC=CS2)C3=CC=CC=C3
ETHYL6PHENYL2SULFANYLIDENE4THIOPHEN2YL34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl6phenyl4(thiophen2yl)2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC17H16N2O2S2c122116(20)1314(117435811)1817(22)1915(13)1296102312h31015H2H21H3(H2181922)
MFCD01821837
ZINC000000052745
ZINC000000052746

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Available files

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