Vitas-M small molecule compound

methyl 3-{[(2-chlorophenoxy)acetyl]amino}-4-(4-ethylpiperazin-1-yl)benzoate

Catalog ID
STK189129
SMILES CCN1CCN(CC1)c1ccc(cc1NC(=O)COc1ccccc1Cl)C(=O)OC

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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 C22H26ClN3O4 MW 431.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26ClN3O4/c1-3-25-10-12-26(13-11-25)19-9-8-16(22(28)29-2)14-18(19)24-21(27)15-30-20-7-5-4-6-17(20)23/h4-9,14H,3,10-13,15H2,1-2H3,(H,24,27)
InChIKey
ZQECSFDFITZCEK-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)COC3=CC=CC=C3Cl
InChI=1SC22H26ClN3O4c1325101226(131125)199816(22(28)292)1418(19)2421(27)153020754617(20)23h4914H3101315H212H3(H2427)
METHYL3(((2CHLOROPHENOXY)ACETYL)AMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
methyl3((2(2chlorophenoxy)acetyl)amino)4(4ethylpiperazin1yl)benzoate
MFCD06665214
ZINC000009908010
ZINC9908010

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Available files

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