Vitas-M small molecule compound

ethyl 6-amino-5-cyano-2-methyl-4-[5-(3-nitrophenyl)furan-2-yl]-4H-pyran-3-carboxylate

Catalog ID
STL048506
SMILES CCOC(=O)C1=C(C)OC(=C(C1c1ccc(o1)c1cccc(c1)[N+](=O)[O-])C#N)N

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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 C20H17N3O6 MW 395.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N3O6/c1-3-27-20(24)17-11(2)28-19(22)14(10-21)18(17)16-8-7-15(29-16)12-5-4-6-13(9-12)23(25)26/h4-9,18H,3,22H2,1-2H3
InChIKey
AIGOXBIVXIVAEC-UHFFFAOYSA-N
Synonyms
609335-71-9
609335719
CCOC(=O)C1=C(C)OC(=C(C1c1ccc(o1)c1cccc(c1)(N+)(=O)(O))C#N)N
CCOC(=O)C1=C(OC(=C(C1C2=CC=C(O2)C3=CC(=CC=C3)(N+)(=O)(O))C#N)N)C
ethyl6amino5cyano2methyl4(5(3nitrophenyl)furan2yl)4Hpyran3carboxylate
InChI=1SC20H17N3O6c132720(24)1711(2)2819(22)14(1021)18(17)168715(2916)1254613(912)23(25)26h4918H322H212H3
MFCD02292537
ZINC000005196049
ZINC000005196059

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Available files

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