Vitas-M small molecule compound

methyl 4-[2-amino-3-cyano-6-(furan-2-ylmethyl)-7-methyl-5-oxo-5,6-dihydro-4H-pyrano[3,2-c]pyridin-4-yl]benzoate

Catalog ID
STK202778
SMILES COC(=O)c1ccc(cc1)C1C(=C(N)Oc2c1c(=O)n(c(c2)C)Cc1ccco1)C#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 C23H19N3O5 MW 417.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19N3O5/c1-13-10-18-20(22(27)26(13)12-16-4-3-9-30-16)19(17(11-24)21(25)31-18)14-5-7-15(8-6-14)23(28)29-2/h3-10,19H,12,25H2,1-2H3
InChIKey
KVCNBTTZJSAUNL-UHFFFAOYSA-N
Synonyms
827000-61-3
827000613
CC1=CC2=C(C(C(=C(O2)N)C#N)C3=CC=C(C=C3)C(=O)OC)C(=O)N1CC4=CC=CO4
InChI=1SC23H19N3O5c113101820(22(27)26(13)12164393016)19(17(1124)21(25)3118)145715(8614)23(28)292h31019H1225H212H3
METHYL4((4R)2AMINO3CYANO6(FURAN2YLMETHYL)7METHYL5OXO56DIHYDRO4HPYRANO(32C)PYRIDIN4YL)BENZOATE
METHYL4((4S)2AMINO3CYANO6(FURAN2YLMETHYL)7METHYL5OXO56DIHYDRO4HPYRANO(32C)PYRIDIN4YL)BENZOATE
METHYL4(2AMINO3CYANO6(2FURYLMETHYL)7METHYL5OXO6HYDRO4HPYRANO(32C)PYRIDIN4YL)BENZOATE
METHYL4(2AMINO3CYANO6(FURAN2YLMETHYL)7METHYL5OXO4HPYRANO(32C)PYRIDIN4YL)BENZOATE
methyl4(2amino3cyano6(furan2ylmethyl)7methyl5oxo56dihydro4Hpyrano(32c)pyridin4yl)benzoate
MFCD06608938
ZINC000002341691
ZINC000002341692

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Available files

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