Vitas-M small molecule compound

2-[({2-[4-(cyclopentylcarbonyl)piperazin-1-yl]ethyl}amino)methylidene]-5,5-dimethylcyclohexane-1,3-dione

Catalog ID
STK043622
SMILES O=C(N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C)C1CCCC1

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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 C21H33N3O3 MW 375.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H33N3O3/c1-21(2)13-18(25)17(19(26)14-21)15-22-7-8-23-9-11-24(12-10-23)20(27)16-5-3-4-6-16/h15-16,22H,3-14H2,1-2H3
InChIKey
UAIVXKKWVOJIBF-UHFFFAOYSA-N
Synonyms
329731-43-3
2(((2(4(CYCLOPENTYLCARBONYL)PIPERAZIN1YL)ETHYL)AMINO)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
2((2(4(CYCLOPENTANECARBONYL)PIPERAZIN1YL)ETHYLAMINO)METHYLIDENE)55DIMETHYLCYCLOHEXANE13DIONE
329731433
CC1(CC(=O)C(=CNCCN2CCN(CC2)C(=O)C3CCCC3)C(=O)C1)C
InChI=1SC21H33N3O3c121(2)1318(25)17(19(26)1421)1522782391124(121023)20(27)16534616h151622H314H212H3
MFCD01417572
O=C(N1CCN(CC1)CCNC=C1C(=O)CC(CC1=O)(C)C)C1CCCC1
STK043622
ZINC000100526652
ZINC100526652

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Available files

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