Vitas-M small molecule compound

N-{4-[4,4-dimethyl-6-oxo-2-(prop-2-en-1-ylamino)cyclohex-1-en-1-yl]-4-oxobutyl}-N'-(prop-2-en-1-yl)benzene-1,2-dicarboxamide

Catalog ID
STK681036
SMILES C=CCNC1=C(C(=O)CCCNC(=O)c2ccccc2C(=O)NCC=C)C(=O)CC(C1)(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 C26H33N3O4 MW 451.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H33N3O4/c1-5-13-27-20-16-26(3,4)17-22(31)23(20)21(30)12-9-15-29-25(33)19-11-8-7-10-18(19)24(32)28-14-6-2/h5-8,10-11,27H,1-2,9,12-17H2,3-4H3,(H,28,32)(H,29,33)
InChIKey
MIAAZRJBYITALJ-UHFFFAOYSA-N
Synonyms
1N(4(44DIMETHYL6OXO2(PROP2ENYLAMINO)CYCLOHEXEN1YL)4OXOBUTYL)2NPROP2ENYLBENZENE12DICARBOXAMIDE
CC1(CC(=C(C(=O)C1)C(=O)CCCNC(=O)C2=CC=CC=C2C(=O)NCC=C)NCC=C)C
N(4(44dimethyl6oxo2(prop2en1ylamino)cyclohex1en1yl)4oxobutyl)N(prop2en1yl)benzene12dicarboxamide
Registry IDs
MFCD03768046
ZINC000100138576
ZINC100138576

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.