Vitas-M small molecule compound

[2-oxo-1-(prop-2-yn-1-yl)-1,2-dihydro-3H-indol-3-ylidene]propanedinitrile

Catalog ID
STK080946
SMILES C#CCN1C(=O)C(=C(C#N)C#N)c2c1cccc2

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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 C14H7N3O MW 233.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H7N3O/c1-2-7-17-12-6-4-3-5-11(12)13(14(17)18)10(8-15)9-16/h1,3-6H,7H2
InChIKey
DFBZHHPSVVCIFJ-UHFFFAOYSA-N
Synonyms

(2OXO1(PROP2YN1YL)12DIHYDRO3HINDOL3YLIDENE)PROPANEDINITRILE
(2OXO1PROP2YNYLBENZO(D)AZOLIN3YLIDENE)METHANE11DICARBONITRILE
2(2OXO1PROP2YNYLINDOL3YLIDENE)PROPANEDINITRILE
C#CCN1C(=O)C(=C(C#N)C#N)c2c1cccc2
C#CCN1C2=CC=CC=C2C(=C(C#N)C#N)C1=O
InChI=1SC14H7N3Oc1271712643511(12)13(14(17)18)10(815)916h136H7H2
MFCD02104155
STK080946
ZINC000000565380
ZINC00565380
ZINC565380

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Available files

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