Vitas-M small molecule compound

(2E)-N-{4-[(2,6-dimethoxypyrimidin-4-yl)sulfamoyl]phenyl}-3-(naphthalen-1-yl)prop-2-enamide

Catalog ID
STK066576
SMILES COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=O)/C=C/c1cccc2c1cccc2

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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 C25H22N4O5S MW 490.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N4O5S/c1-33-24-16-22(27-25(28-24)34-2)29-35(31,32)20-13-11-19(12-14-20)26-23(30)15-10-18-8-5-7-17-6-3-4-9-21(17)18/h3-16H,1-2H3,(H,26,30)(H,27,28,29)/b15-10+
InChIKey
LBKQLXLAIXLABO-XNTDXEJSSA-N
Synonyms
356100-48-6
(2E)N(4(((26DIMETHOXYPYRIMIDIN4YL)AMINO)SULFONYL)PHENYL)3NAPHTHYLPROP2ENAMIDE
(2E)N(4((26DIMETHOXYPYRIMIDIN4YL)SULFAMOYL)PHENYL)3(NAPHTHALEN1YL)PROP2ENAMIDE
(E)N(4((26DIMETHOXYPYRIMIDIN4YL)SULFAMOYL)PHENYL)3NAPHTHALEN1YLPROP2ENAMIDE
356100486
COC1=NC(=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C=CC3=CC=CC4=CC=CC=C43)OC
COc1nc(OC)nc(c1)NS(=O)(=O)c1ccc(cc1)NC(=O)C=Cc1cccc2c1cccc2
InChI=1SC25H22N4O5Sc133241622(2725(2824)342)2935(3132)20131119(121420)2623(30)15101885717634921(17)18h316H12H3(H2630)(H272829)b1510+
MFCD02975591
STK066576
ZINC000001174529
ZINC01174529
ZINC1174529

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Available files

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