Vitas-M small molecule compound

ethyl 6-methyl-4-[(E)-2-phenylethenyl]-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate

Catalog ID
STK701071
SMILES CCOC(=O)C1=C(C)NC(=S)NC1/C=C/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 C16H18N2O2S MW 302.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O2S/c1-3-20-15(19)14-11(2)17-16(21)18-13(14)10-9-12-7-5-4-6-8-12/h4-10,13H,3H2,1-2H3,(H2,17,18,21)/b10-9+
InChIKey
AMECLYLJNKGTGH-MDZDMXLPSA-N
Synonyms
948052-26-4
(E)ethyl6methyl4styryl2thioxo1234tetrahydropyrimidine5carboxylate
948052264
CCOC(=O)C1=C(C)NC(=S)NC1C=Cc1ccccc1
CCOC(=O)C1=C(NC(=S)NC1C=CC2=CC=CC=C2)C
ETHYL6METHYL4((E)2PHENYLETHENYL)2SULFANYLIDENE34DIHYDRO1HPYRIMIDINE5CARBOXYLATE
ethyl6methyl4((E)2phenylethenyl)2thioxo1234tetrahydropyrimidine5carboxylate
InChI=1SC16H18N2O2Sc132015(19)1411(2)1716(21)1813(14)109127546812h41013H3H212H3(H2171821)b109+
MFCD00486525
ZINC000002489603
ZINC000002489605

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Available files

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