Vitas-M small molecule compound

benzyl 6-amino-5-cyano-2-methyl-4-(thiophen-3-yl)-4H-pyran-3-carboxylate

Catalog ID
STK748657
SMILES N#CC1=C(N)OC(=C(C1c1cscc1)C(=O)OCc1ccccc1)C

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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 C19H16N2O3S MW 352.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3S/c1-12-16(19(22)23-10-13-5-3-2-4-6-13)17(14-7-8-25-11-14)15(9-20)18(21)24-12/h2-8,11,17H,10,21H2,1H3
InChIKey
ZEHTUBUZWUKNAN-UHFFFAOYSA-N
Synonyms
339581-00-9
339581009
6AMINO5CYANO2METHYL4THIOPHEN3YL4HPYRAN3CARBOXYLICACIDBENZYLESTER
benzyl6amino5cyano2methyl4(thiophen3yl)4Hpyran3carboxylate
BENZYL6AMINO5CYANO2METHYL4THIOPHEN3YL4HPYRAN3CARBOXYLATE
CC1=C(C(C(=C(O1)N)C#N)C2=CSC=C2)C(=O)OCC3=CC=CC=C3
InChI=1SC19H16N2O3Sc11216(19(22)2310135324613)17(1478251114)15(920)18(21)2412h281117H1021H21H3
MFCD00743647
ZINC000000705930
ZINC000000705931

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Available files

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