Vitas-M small molecule compound

(2E)-2-cyano-3-[4-(methylsulfanyl)phenyl]prop-2-enamide

Catalog ID
STK414073
SMILES CSc1ccc(cc1)/C=C(/C(=O)N)\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 C11H10N2OS MW 218.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H10N2OS/c1-15-10-4-2-8(3-5-10)6-9(7-12)11(13)14/h2-6H,1H3,(H2,13,14)/b9-6+
InChIKey
MRODCNCPVWXKAT-RMKNXTFCSA-N
Synonyms

(2E)2cyano3(4(methylsulfanyl)phenyl)prop2enamide
(2E)2CYANO3(4METHYLTHIOPHENYL)PROP2ENAMIDE
(E)2CYANO3(4METHYLSULFANYLPHENYL)PROP2ENAMIDE
CSC1=CC=C(C=C1)C=C(C#N)C(=O)N
CSc1ccc(cc1)C=C(C(=O)N)C#N
InChI=1SC11H10N2OSc11510428(3510)69(712)11(13)14h26H1H3(H21314)b96+
MFCD00176696
ZINC000012368670
ZINC12368670

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Available files

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