Vitas-M small molecule compound

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

Catalog ID
STK189100
SMILES CCN1CCN(CC1)c1ccc(cc1NC(=O)COc1ccc(cc1)Cl)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)20-9-4-16(22(28)29-2)14-19(20)24-21(27)15-30-18-7-5-17(23)6-8-18/h4-9,14H,3,10-13,15H2,1-2H3,(H,24,27)
InChIKey
GPVZKXKENGFCTO-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)COC3=CC=C(C=C3)Cl
InChI=1SC22H26ClN3O4c1325101226(131125)209416(22(28)292)1419(20)2421(27)1530187517(23)6818h4914H3101315H212H3(H2427)
METHYL3(((4CHLOROPHENOXY)ACETYL)AMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
methyl3((2(4chlorophenoxy)acetyl)amino)4(4ethylpiperazin1yl)benzoate
MFCD06665186
ZINC000009907995
ZINC9907995

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Available files

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