Vitas-M small molecule compound

methyl 3-{[(3-bromophenyl)carbonyl]amino}-4-(4-ethylpiperazin-1-yl)benzoate

Catalog ID
STK219958
SMILES CCN1CCN(CC1)c1ccc(cc1NC(=O)c1cccc(c1)Br)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 C21H24BrN3O3 MW 446.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24BrN3O3/c1-3-24-9-11-25(12-10-24)19-8-7-16(21(27)28-2)14-18(19)23-20(26)15-5-4-6-17(22)13-15/h4-8,13-14H,3,9-12H2,1-2H3,(H,23,26)
InChIKey
GMMKIABFVUDNOT-UHFFFAOYSA-N
Synonyms
767299-94-5
767299945
CCN1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=CC(=CC=C3)Br
InChI=1SC21H24BrN3O3c132491125(121024)198716(21(27)282)1418(19)2320(26)1554617(22)1315h481314H3912H212H3(H2326)
METHYL3(((3BROMOPHENYL)CARBONYL)AMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
METHYL3((3BROMOBENZOYL)AMINO)4(4ETHYL1PIPERAZINYL)BENZOATE
methyl3((3bromobenzoyl)amino)4(4ethylpiperazin1yl)benzoate
MFCD06665446
ZINC000010059893
ZINC10059893

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Available files

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