Vitas-M small molecule compound

N-(5-chloro-2-methoxyphenyl)-2-[3-(4-methylphenyl)-6-oxopyridazin-1(6H)-yl]butanamide

Catalog ID
STK358953
SMILES CCC(n1nc(ccc1=O)c1ccc(cc1)C)C(=O)Nc1cc(Cl)ccc1OC

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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 C22H22ClN3O3 MW 411.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O3/c1-4-19(22(28)24-18-13-16(23)9-11-20(18)29-3)26-21(27)12-10-17(25-26)15-7-5-14(2)6-8-15/h5-13,19H,4H2,1-3H3,(H,24,28)
InChIKey
CNURMUBXDVKCOK-UHFFFAOYSA-N
Synonyms

CCC(C(=O)NC1=C(C=CC(=C1)Cl)OC)N2C(=O)C=CC(=N2)C3=CC=C(C=C3)C
InChI=1SC22H22ClN3O3c1419(22(28)24181316(23)91120(18)293)2621(27)121017(2526)157514(2)6815h51319H4H213H3(H2428)
MFCD11852275
N(5chloro2methoxyphenyl)2(3(4methylphenyl)6oxopyridazin1(6H)yl)butanamide
N(5chloro2methoxyphenyl)2(3(4methylphenyl)6oxopyridazin1yl)butanamide
ZINC000006767184
ZINC000006767185

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Available files

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