Vitas-M small molecule compound

3-bromo-N-[2-(cyclohex-1-en-1-yl)ethyl]-4-methylbenzamide

Catalog ID
STK040196
SMILES O=C(c1ccc(c(c1)Br)C)NCCC1=CCCCC1

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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 C16H20BrNO MW 322.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20BrNO/c1-12-7-8-14(11-15(12)17)16(19)18-10-9-13-5-3-2-4-6-13/h5,7-8,11H,2-4,6,9-10H2,1H3,(H,18,19)
InChIKey
NFJHWNSIKXSSAT-UHFFFAOYSA-N
Synonyms

(3BROMO4METHYLPHENYL)N(2CYCLOHEX1ENYLETHYL)CARBOXAMIDE
3BROMON(2(CYCLOHEX1EN1YL)ETHYL)4METHYLBENZAMIDE
3BROMON(2(CYCLOHEXEN1YL)ETHYL)4METHYLBENZAMIDE
3BROMON(2CYCLOHEX1EN1YLETHYL)4METHYLBENZAMIDE
CC1=C(C=C(C=C1)C(=O)NCCC2=CCCCC2)Br
InChI=1SC16H20BrNOc1127814(1115(12)17)16(19)18109135324613h57811H246910H21H3(H1819)
MFCD03306044
O=C(c1ccc(c(c1)Br)C)NCCC1=CCCCC1
STK040196
ZINC000000142646
ZINC00142646
ZINC142646

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Available files

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