Vitas-M small molecule compound
propyl {1-[(5-bromo-2-butoxyphenyl)carbonyl]-3-oxopiperazin-2-yl}acetate
Catalog ID
STL066169
SMILES CCCCOc1ccc(cc1C(=O)N1CCNC(=O)C1CC(=O)OCCC)Br
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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 C20H27BrN2O5 MW 455.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27BrN2O5/c1-3-5-11-27-17-7-6-14(21)12-15(17)20(26)23-9-8-22-19(25)16(23)13-18(24)28-10-4-2/h6-7,12,16H,3-5,8-11,13H2,1-2H3,(H,22,25)InChIKey
GNWFCKHTHLZIPN-UHFFFAOYSA-NSynonyms
CCCCOC1=C(C=C(C=C1)Br)C(=O)N2CCNC(=O)C2CC(=O)OCCC
InChI=1SC20H27BrN2O5c1351127177614(21)1215(17)20(26)23982219(25)16(23)1318(24)281042h671216H3581113H212H3(H2225)
MFCD07548718
propyl(1((5bromo2butoxyphenyl)carbonyl)3oxopiperazin2yl)acetate
propyl2(1(5bromo2butoxybenzoyl)3oxopiperazin2yl)acetate
ZINC000012137748
ZINC000012137749
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