Vitas-M small molecule compound

ethyl 5-({[1-(3-methylphenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)-4-phenylthiophene-3-carboxylate

Catalog ID
STK913344
SMILES CCOC(=O)c1csc(c1c1ccccc1)NC(=O)c1nn(ccc1=O)c1cccc(c1)C

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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 C25H21N3O4S MW 459.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21N3O4S/c1-3-32-25(31)19-15-33-24(21(19)17-9-5-4-6-10-17)26-23(30)22-20(29)12-13-28(27-22)18-11-7-8-16(2)14-18/h4-15H,3H2,1-2H3,(H,26,30)
InChIKey
TVFJUANUCLGUJC-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CSC(=C1C2=CC=CC=C2)NC(=O)C3=NN(C=CC3=O)C4=CC=CC(=C4)C
ethyl5(((1(3methylphenyl)4oxo14dihydropyridazin3yl)carbonyl)amino)4phenylthiophene3carboxylate
ethyl5((1(3methylphenyl)4oxopyridazine3carbonyl)amino)4phenylthiophene3carboxylate
InChI=1SC25H21N3O4Sc133225(31)19153324(21(19)1795461017)2623(30)2220(29)121328(2722)18117816(2)1418h415H3H212H3(H2630)
MFCD07428298
ZINC000012062538
ZINC12062538

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Available files

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