Vitas-M small molecule compound
methyl 4-(4-acetylpiperazin-1-yl)-3-{[(5-bromo-2-chlorophenyl)carbonyl]amino}benzoate
Catalog ID
STK180006
SMILES COC(=O)c1ccc(c(c1)NC(=O)c1cc(Br)ccc1Cl)N1CCN(CC1)C(=O)C
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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 C21H21BrClN3O4 MW 494.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrClN3O4/c1-13(27)25-7-9-26(10-8-25)19-6-3-14(21(29)30-2)11-18(19)24-20(28)16-12-15(22)4-5-17(16)23/h3-6,11-12H,7-10H2,1-2H3,(H,24,28)InChIKey
OGLFNDDTUAIHOQ-UHFFFAOYSA-NSynonyms
CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)OC)NC(=O)C3=C(C=CC(=C3)Br)Cl
InChI=1SC21H21BrClN3O4c113(27)257926(10825)196314(21(29)302)1118(19)2420(28)161215(22)4517(16)23h361112H710H212H3(H2428)
METHYL4(4ACETYLPIPERAZIN1YL)3(((5BROMO2CHLOROPHENYL)CARBONYL)AMINO)BENZOATE
methyl4(4acetylpiperazin1yl)3((5bromo2chlorobenzoyl)amino)benzoate
MFCD06664246
ZINC000009892728
ZINC09892728
ZINC9892728
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