Vitas-M small molecule compound

1-butyl-3-(thiophen-2-ylcarbonyl)-1-azoniabicyclo[2.2.2]octane

Catalog ID
STK727147
SMILES CCCC[N+]12CCC(CC1)C(C2)C(=O)c1cccs1

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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 C16H24NOS MW 278.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H24NOS/c1-2-3-8-17-9-6-13(7-10-17)14(12-17)16(18)15-5-4-11-19-15/h4-5,11,13-14H,2-3,6-10,12H2,1H3/q+1
InChIKey
VBKDCCYHJRMCOJ-UHFFFAOYSA-N
Synonyms

(1BUTYL1AZONIABICYCLO(222)OCTAN3YL)THIOPHEN2YLMETHANONE
(3R)1BUTYL3(THIOPHEN2YLCARBONYL)1AZONIABICYCLO(222)OCTANE
(3S)1BUTYL3(THIOPHEN2YLCARBONYL)1AZONIABICYCLO(222)OCTANE
1BUTYL3(THIOPHEN2YLCARBONYL)1AZONIABICYCLO(222)OCTANE
1BUTYLQUINUCLIDIN3YL2THIENYLKETONE
CCCC(N+)12CCC(CC1)C(C2)C(=O)c1cccs1
CCCC(N+)12CCC(CC1)C(C2)C(=O)C3=CC=CS3
InChI=1SC16H24NOSc1238179613(71017)14(1217)16(18)1554111915h45111314H2361012H21H3q+1
ZINC000001741932
ZINC000001741936

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Available files

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