Vitas-M small molecule compound

ethyl 2-amino-5-oxo-4-phenyl-1-(4-sulfamoylphenyl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK675920
SMILES CCOC(=O)C1=C(N)N(C2=C(C1c1ccccc1)C(=O)CCC2)c1ccc(cc1)S(=O)(=O)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 C24H25N3O5S MW 467.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H25N3O5S/c1-2-32-24(29)22-20(15-7-4-3-5-8-15)21-18(9-6-10-19(21)28)27(23(22)25)16-11-13-17(14-12-16)33(26,30)31/h3-5,7-8,11-14,20H,2,6,9-10,25H2,1H3,(H2,26,30,31)
InChIKey
NERILMCXNQDQPJ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(N(C2=C(C1C3=CC=CC=C3)C(=O)CCC2)C4=CC=C(C=C4)S(=O)(=O)N)N
ethyl2amino5oxo4phenyl1(4sulfamoylphenyl)145678hexahydroquinoline3carboxylate
ethyl2amino5oxo4phenyl1(4sulfamoylphenyl)4678tetrahydroquinoline3carboxylate
InChI=1SC24H25N3O5Sc123224(29)2220(157435815)2118(961019(21)28)27(23(22)25)16111317(141216)33(2630)31h3578111420H2691025H21H3(H2263031)
MFCD01821039
ZINC000001065089
ZINC000001065091

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Available files

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