Vitas-M small molecule compound

(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)propanedinitrile

Catalog ID
STK377286
SMILES N#CC(=c1sc2c(n1CC)cccc2)C#N

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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 C12H9N3S MW 227.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N3S/c1-2-15-10-5-3-4-6-11(10)16-12(15)9(7-13)8-14/h3-6H,2H2,1H3
InChIKey
FUVOBUXIWKXOPC-UHFFFAOYSA-N
Synonyms
61681-11-6
(3ethyl13benzothiazol2(3H)ylidene)propanedinitrile
(3ETHYL3HYDROBENZOTHIAZOL2YLIDENE)METHANE11DICARBONITRILE
2(3ETHYL13BENZOTHIAZOL2YLIDENE)PROPANEDINITRILE
2(3ETHYL23DIHYDRO13BENZOTHIAZOL2YLIDENE)PROPANEDINITRILE
61681116
CCN1C2=CC=CC=C2SC1=C(C#N)C#N
InChI=1SC12H9N3Sc121510534611(10)1612(15)9(713)814h36H2H21H3
MFCD01527782
ZINC000000406644
ZINC00406644
ZINC406644

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Available files

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