Vitas-M small molecule compound
methyl 3-{[(3-bromo-4-ethoxyphenyl)carbonyl]amino}-4-[4-(phenylcarbonyl)piperazin-1-yl]benzoate
Catalog ID
STK188909
SMILES CCOc1ccc(cc1Br)C(=O)Nc1cc(ccc1N1CCN(CC1)C(=O)c1ccccc1)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 C28H28BrN3O5 MW 566.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28BrN3O5/c1-3-37-25-12-10-20(17-22(25)29)26(33)30-23-18-21(28(35)36-2)9-11-24(23)31-13-15-32(16-14-31)27(34)19-7-5-4-6-8-19/h4-12,17-18H,3,13-16H2,1-2H3,(H,30,33)InChIKey
XRSIJZADHBWJQN-UHFFFAOYSA-NSynonyms
CCOC1=C(C=C(C=C1)C(=O)NC2=C(C=CC(=C2)C(=O)OC)N3CCN(CC3)C(=O)C4=CC=CC=C4)Br
InChI=1SC28H28BrN3O5c133725121020(1722(25)29)26(33)30231821(28(35)362)91124(23)31131532(161431)27(34)197546819h4121718H31316H212H3(H3033)
METHYL3(((3BROMO4ETHOXYPHENYL)CARBONYL)AMINO)4(4(PHENYLCARBONYL)PIPERAZIN1YL)BENZOATE
methyl4(4benzoylpiperazin1yl)3((3bromo4ethoxybenzoyl)amino)benzoate
MFCD06665003
ZINC000097995654
ZINC97995654
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