Vitas-M small molecule compound

ethyl 2-({[1-(3-chlorophenyl)-4-oxo-1,4-dihydropyridazin-3-yl]carbonyl}amino)-4,5-dimethylthiophene-3-carboxylate

Catalog ID
STK517487
SMILES CCOC(=O)c1c(sc(c1C)C)NC(=O)c1nn(ccc1=O)c1cccc(c1)Cl

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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 C20H18ClN3O4S MW 431.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18ClN3O4S/c1-4-28-20(27)16-11(2)12(3)29-19(16)22-18(26)17-15(25)8-9-24(23-17)14-7-5-6-13(21)10-14/h5-10H,4H2,1-3H3,(H,22,26)
InChIKey
QKXBTWOEQXPGJY-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C)C)NC(=O)C2=NN(C=CC2=O)C3=CC(=CC=C3)Cl
ethyl2(((1(3chlorophenyl)4oxo14dihydropyridazin3yl)carbonyl)amino)45dimethylthiophene3carboxylate
ethyl2((1(3chlorophenyl)4oxopyridazine3carbonyl)amino)45dimethylthiophene3carboxylate
InChI=1SC20H18ClN3O4Sc142820(27)1611(2)12(3)2919(16)2218(26)1715(25)8924(2317)1475613(21)1014h510H4H213H3(H2226)
MFCD08549717
ZINC000012111353
ZINC12111353

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Available files

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