Vitas-M small molecule compound

methyl 4-(4-acetylpiperazin-1-yl)-3-{[(2-chloro-4-methylphenyl)carbonyl]amino}benzoate

Catalog ID
STK183516
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1ccc(cc1Cl)C)N1CCN(CC1)C(=O)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 C22H24ClN3O4 MW 429.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24ClN3O4/c1-14-4-6-17(18(23)12-14)21(28)24-19-13-16(22(29)30-3)5-7-20(19)26-10-8-25(9-11-26)15(2)27/h4-7,12-13H,8-11H2,1-3H3,(H,24,28)
InChIKey
LYGSFPZGHNCULB-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C)Cl
InChI=1SC22H24ClN3O4c1144617(18(23)1214)21(28)24191316(22(29)303)5720(19)2610825(91126)15(2)27h471213H811H213H3(H2428)
METHYL4(4ACETYLPIPERAZIN1YL)3(((2CHLORO4METHYLPHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4acetylpiperazin1yl)3((2chloro4methylbenzoyl)amino)benzoate
MFCD06664403
ZINC000009906164
ZINC09906164
ZINC9906164

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Available files

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