Vitas-M small molecule compound

N,N-bis(cyanomethyl)-3-methylbenzamide

Catalog ID
STK043553
SMILES N#CCN(C(=O)c1cccc(c1)C)CC#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 C12H11N3O MW 213.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11N3O/c1-10-3-2-4-11(9-10)12(16)15(7-5-13)8-6-14/h2-4,9H,7-8H2,1H3
InChIKey
GSPAQYYQWZCQHY-UHFFFAOYSA-N
Synonyms

CC1=CC=CC(=C1)C(=O)N(CC#N)CC#N
InChI=1SC12H11N3Oc11032411(910)12(16)15(7513)8614h249H78H21H3
MFCD01212473
N#CCN(C(=O)c1cccc(c1)C)CC#N
NNBIS(CYANOMETHYL)(3METHYLPHENYL)CARBOXAMIDE
NNBIS(CYANOMETHYL)3METHYLBENZAMIDE
NNBISCYANOMETHYL3METHYLBENZAMIDE
STK043553
ZINC000000101301
ZINC00101301
ZINC101301

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Available files

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