Vitas-M small molecule compound

methyl 6-amino-5-cyano-4-{4-methoxy-3-[(4-methylphenoxy)methyl]phenyl}-2-methyl-4H-pyran-3-carboxylate

Catalog ID
STL173752
SMILES COC(=O)C1=C(C)OC(=C(C1c1ccc(c(c1)COc1ccc(cc1)C)OC)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 C24H24N2O5 MW 420.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N2O5/c1-14-5-8-18(9-6-14)30-13-17-11-16(7-10-20(17)28-3)22-19(12-25)23(26)31-15(2)21(22)24(27)29-4/h5-11,22H,13,26H2,1-4H3
InChIKey
HLDOLHGADDWOJP-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)OCC2=C(C=CC(=C2)C3C(=C(OC(=C3C(=O)OC)C)N)C#N)OC
InChI=1SC24H24N2O5c1145818(9614)3013171116(71020(17)283)2219(1225)23(26)3115(2)21(22)24(27)294h51122H1326H214H3
methyl6amino5cyano4(4methoxy3((4methylphenoxy)methyl)phenyl)2methyl4Hpyran3carboxylate
MFCD02243616
ZINC000000649226
ZINC000000649228

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Available files

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