Vitas-M small molecule compound

methyl 3-{[(3-ethoxyphenyl)carbonyl]amino}-4-(4-methylpiperazin-1-yl)benzoate

Catalog ID
STK892278
SMILES CCOc1cccc(c1)C(=O)Nc1cc(ccc1N1CCN(CC1)C)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 C22H27N3O4 MW 397.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O4/c1-4-29-18-7-5-6-16(14-18)21(26)23-19-15-17(22(27)28-3)8-9-20(19)25-12-10-24(2)11-13-25/h5-9,14-15H,4,10-13H2,1-3H3,(H,23,26)
InChIKey
LRMVEWOGELALPM-UHFFFAOYSA-N
Synonyms

CCOC1=CC=CC(=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C
InChI=1SC22H27N3O4c14291875616(1418)21(26)23191517(22(27)283)8920(19)25121024(2)111325h591415H41013H213H3(H2326)
methyl3(((3ethoxyphenyl)carbonyl)amino)4(4methylpiperazin1yl)benzoate
METHYL3((3ETHOXYBENZOYL)AMINO)4(4METHYL1PIPERAZINYL)BENZOATE
METHYL3((3ETHOXYBENZOYL)AMINO)4(4METHYLPIPERAZIN1YL)BENZOATE
MFCD08067947
ZINC000006700742
ZINC6700742

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Available files

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