Vitas-M small molecule compound

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

Catalog ID
STK755351
SMILES COCC1=C(C(=O)OC)C(C(=C(O1)N)C#N)c1cccs1

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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 C14H14N2O4S MW 306.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14N2O4S/c1-18-7-9-12(14(17)19-2)11(10-4-3-5-21-10)8(6-15)13(16)20-9/h3-5,11H,7,16H2,1-2H3
InChIKey
UHRVXMHJGLVNSP-UHFFFAOYSA-N
Synonyms
311763-07-2
311763072
COCC1=C(C(C(=C(O1)N)C#N)C2=CC=CS2)C(=O)OC
InChI=1SC14H14N2O4Sc1187912(14(17)192)11(104352110)8(615)13(16)209h3511H716H212H3
methyl6amino5cyano2(methoxymethyl)4(thiophen2yl)4Hpyran3carboxylate
METHYL6AMINO5CYANO2(METHOXYMETHYL)4THIOPHEN2YL4HPYRAN3CARBOXYLATE
MFCD00827862
ZINC000004474174
ZINC000004474175

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Available files

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