Vitas-M small molecule compound

(1-butyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)propanedinitrile

Catalog ID
STK004314
SMILES CCCCN1c2ccccc2C(=C(C#N)C#N)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 C15H13N3O MW 251.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O/c1-2-3-8-18-13-7-5-4-6-12(13)14(15(18)19)11(9-16)10-17/h4-7H,2-3,8H2,1H3
InChIKey
RKPZYPLSYDDQFO-UHFFFAOYSA-N
Synonyms

(1BUTYL2OXO12DIHYDRO3HINDOL3YLIDENE)PROPANEDINITRILE
2(1BUTYL2OXOINDOL3YLIDENE)PROPANEDINITRILE
CCCCN1C2=CC=CC=C2C(=C(C#N)C#N)C1=O
CCCCN1c2ccccc2C(=C(C#N)C#N)C1=O
InChI=1SC15H13N3Oc12381813754612(13)14(15(18)19)11(916)1017h47H238H21H3
MFCD05042787
STK004314
ZINC000004549746
ZINC04549746
ZINC4549746

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Available files

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