Vitas-M small molecule compound

(5Z)-2-(1,3-dithiolan-2-ylidene)-5-(4-methoxybenzylidene)cyclopentanone

Catalog ID
STK993230
SMILES COc1ccc(cc1)/C=C\1/CCC(=C2SCCS2)C1=O

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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 C16H16O2S2 MW 304.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O2S2/c1-18-13-5-2-11(3-6-13)10-12-4-7-14(15(12)17)16-19-8-9-20-16/h2-3,5-6,10H,4,7-9H2,1H3/b12-10-
InChIKey
RRYRAWQVLPPSES-BENRWUELSA-N
Synonyms

(5Z)2(13DITHIOLAN2YLIDENE)5((4METHOXYPHENYL)METHYLIDENE)CYCLOPENTAN1ONE
(5Z)2(13dithiolan2ylidene)5(4methoxybenzylidene)cyclopentanone
COC1=CC=C(C=C1)C=C2CCC(=C3SCCS3)C2=O
COc1ccc(cc1)C=C1CCC(=C2SCCS2)C1=O
InChI=1SC16H16O2S2c118135211(3613)10124714(15(12)17)1619892016h235610H479H21H3b1210
MFCD18184799
ZINC000033426825
ZINC33426825

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Available files

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