Vitas-M small molecule compound

(3E,6S)-3-(3-methylbenzylidene)-6-(2-methylpropyl)piperazine-2,5-dione

Catalog ID
STL526731
SMILES CC(C[C@@H]1NC(=O)/C(=C\c2cccc(c2)C)/NC1=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 C16H20N2O2 MW 272.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N2O2/c1-10(2)7-13-15(19)18-14(16(20)17-13)9-12-6-4-5-11(3)8-12/h4-6,8-10,13H,7H2,1-3H3,(H,17,20)(H,18,19)/b14-9+/t13-/m0/s1
InChIKey
VVXVZIGIGDNTDE-FYQHACEVSA-N
Synonyms

(3~(E)6~(S))3((3methylphenyl)methylidene)6(2methylpropyl)piperazine25dione
(3E6S)3((3METHYLPHENYL)METHYLIDENE)6(2METHYLPROPYL)PIPERAZINE25DIONE
(3E6S)3(3methylbenzylidene)6(2methylpropyl)piperazine25dione
(SE)3isobutyl6(3methylbenzylidene)piperazine25dione
6545171
CC(C(C@@H)1NC(=O)C(=Cc2cccc(c2)C)NC1=O)C
InChI=1SC16H20N2O2c110(2)71315(19)1814(16(20)1713)91264511(3)812h4681013H7H213H3(H1720)(H1819)b149+t13m0s1
MFCD03005773
ZINC000004029280
ZINC4029280

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Available files

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