Vitas-M small molecule compound

ethyl 4-(5-acetyl-6-methyl-1-phenyl-2-thioxo-1,2-dihydropyrimidin-4-yl)piperazine-1-carboxylate

Catalog ID
STK081796
SMILES CCOC(=O)N1CCN(CC1)c1nc(=S)n(c(c1C(=O)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 C20H24N4O3S MW 400.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N4O3S/c1-4-27-20(26)23-12-10-22(11-13-23)18-17(15(3)25)14(2)24(19(28)21-18)16-8-6-5-7-9-16/h5-9H,4,10-13H2,1-3H3
InChIKey
PISNNTJHQPYEJO-UHFFFAOYSA-N
Synonyms
329213-80-1
329213801
CCOC(=O)N1CCN(CC1)c1nc(=S)n(c(c1C(=O)C)C)c1ccccc1
CCOC(=O)N1CCN(CC1)C2=NC(=S)N(C(=C2C(=O)C)C)C3=CC=CC=C3
ETHYL4(5ACETYL6METHYL1PHENYL2SULFANYLIDENEPYRIMIDIN4YL)PIPERAZINE1CARBOXYLATE
ETHYL4(5ACETYL6METHYL1PHENYL2THIOXO12DIHYDRO4PYRIMIDINYL)1PIPERAZINECARBOXYLATE
ETHYL4(5ACETYL6METHYL1PHENYL2THIOXO12DIHYDROPYRIMIDIN4YL)PIPERAZINE1CARBOXYLATE
ETHYL4(5ACETYL6METHYL1PHENYL2THIOXOHYDROPYRIMIDIN4YL)PIPERAZINECARBOXYLATE
InChI=1SC20H24N4O3Sc142720(26)23121022(111323)1817(15(3)25)14(2)24(19(28)2118)168657916h59H41013H213H3
MFCD01244109
STK081796
ZINC000000682724
ZINC00682724
ZINC682724

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Available files

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