Vitas-M small molecule compound
ethyl 3-{[(3-bromo-4-ethoxyphenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK189019
SMILES CCOC(=O)c1ccc(c(c1)NC(=O)c1ccc(c(c1)Br)OCC)N1CCN(CC1)C(=O)c1ccccc1
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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 C29H30BrN3O5 MW 580.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30BrN3O5/c1-3-37-26-13-11-21(18-23(26)30)27(34)31-24-19-22(29(36)38-4-2)10-12-25(24)32-14-16-33(17-15-32)28(35)20-8-6-5-7-9-20/h5-13,18-19H,3-4,14-17H2,1-2H3,(H,31,34)InChIKey
NOAKEGFJGGGYKC-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OCC)N3CCN(CC3)C(=O)C4=CC=CC=C4)Br
ETHYL3(((3BROMO4ETHOXYPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
ethyl4(4benzoylpiperazin1yl)3((3bromo4ethoxybenzoyl)amino)benzoate
InChI=1SC29H30BrN3O5c133726131121(1823(26)30)27(34)31241922(29(36)3842)101225(24)32141633(171532)28(35)208657920h5131819H341417H212H3(H3134)
MFCD06665109
ZINC000097948540
ZINC97948540
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