Vitas-M small molecule compound
(3E,6S)-3-(4-methoxybenzylidene)-6-(2-methylpropyl)piperazine-2,5-dione
Catalog ID
STL526995
SMILES COc1ccc(cc1)/C=C\1/NC(=O)[C@@H](NC1=O)CC(C)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 C16H20N2O3 MW 288.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O3/c1-10(2)8-13-15(19)18-14(16(20)17-13)9-11-4-6-12(21-3)7-5-11/h4-7,9-10,13H,8H2,1-3H3,(H,17,20)(H,18,19)/b14-9+/t13-/m0/s1InChIKey
WRKHTOJCCROHLQ-FYQHACEVSA-NSynonyms
(3~(E)6~(S))3((4methoxyphenyl)methylidene)6(2methylpropyl)piperazine25dione
(3E6S)3((4METHOXYPHENYL)METHYLIDENE)6(2METHYLPROPYL)PIPERAZINE25DIONE
(3E6S)3(4methoxybenzylidene)6(2methylpropyl)piperazine25dione
(SE)3isobutyl6(4methoxybenzylidene)piperazine25dione
7079051
COc1ccc(cc1)C=C1NC(=O)(C@@H)(NC1=O)CC(C)C
InChI=1SC16H20N2O3c110(2)81315(19)1814(16(20)1713)9114612(213)7511h4791013H8H213H3(H1720)(H1819)b149+t13m0s1
MFCD03005856
ZINC000004029309
ZINC4029309
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