Vitas-M small molecule compound
(2E)-2-benzylidene-6-(1,3-dithiolan-2-ylidene)cyclohexanone
Catalog ID
STK993165
SMILES O=C1/C(=C/c2ccccc2)/CCCC1=C1SCCS1
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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 C16H16OS2 MW 288.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16OS2/c17-15-13(11-12-5-2-1-3-6-12)7-4-8-14(15)16-18-9-10-19-16/h1-3,5-6,11H,4,7-10H2/b13-11+InChIKey
LBSWEXZHTBWTPR-ACCUITESSA-NSynonyms
(2E)2BENZYLIDENE6(13DITHIOLAN2YLIDENE)CYCLOHEXAN1ONE
(2E)2benzylidene6(13dithiolan2ylidene)cyclohexanone
C1CC(=CC2=CC=CC=C2)C(=O)C(=C3SCCS3)C1
InChI=1SC16H16OS2c171513(11125213612)74814(15)16189101916h135611H4710H2b1311+
MFCD03489635
O=C1C(=Cc2ccccc2)CCCC1=C1SCCS1
ZINC000003351228
ZINC03351228
ZINC3351228
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