Vitas-M small molecule compound

N,N-bis(cyanomethyl)-3,4,5-triethoxybenzamide

Catalog ID
STK020528
SMILES CCOc1cc(cc(c1OCC)OCC)C(=O)N(CC#N)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 C17H21N3O4 MW 331.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O4/c1-4-22-14-11-13(17(21)20(9-7-18)10-8-19)12-15(23-5-2)16(14)24-6-3/h11-12H,4-6,9-10H2,1-3H3
InChIKey
NTLTXWSXOXRWHM-UHFFFAOYSA-N
Synonyms
349400-81-3
349400813
CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CC#N)CC#N
CCOc1cc(cc(c1OCC)OCC)C(=O)N(CC#N)CC#N
InChI=1SC17H21N3O4c1422141113(17(21)20(9718)10819)1215(2352)16(14)2463h1112H46910H213H3
MFCD01993495
NNBIS(CYANOMETHYL)(345TRIETHOXYPHENYL)CARBOXAMIDE
NNBIS(CYANOMETHYL)345TRIETHOXYBENZAMIDE
STK020528
ZINC000000030215
ZINC00030215
ZINC30215

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Available files

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