Vitas-M small molecule compound
methyl 3-acetyl-6-amino-5-cyano-4-(4-methylphenyl)-4H-pyran-2-carboxylate
Catalog ID
STL176718
SMILES COC(=O)C1=C(C(=O)C)C(C(=C(O1)N)C#N)c1ccc(cc1)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 C17H16N2O4 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H16N2O4/c1-9-4-6-11(7-5-9)14-12(8-18)16(19)23-15(17(21)22-3)13(14)10(2)20/h4-7,14H,19H2,1-3H3InChIKey
JANWLSGGHCKVNF-UHFFFAOYSA-NSynonyms
677025-30-8677025308
CC1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)C)C(=O)OC)N)C#N
InChI=1SC17H16N2O4c194611(759)1412(818)16(19)2315(17(21)223)13(14)10(2)20h4714H19H213H3
methyl3acetyl6amino5cyano4(4methylphenyl)4Hpyran2carboxylate
MFCD04050504
ZINC000002786136
ZINC000002786137
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