Vitas-M small molecule compound

4-{4-[2-(dimethylamino)ethyl]piperidin-1-yl}-5-nitrobenzene-1,2-dicarbonitrile

Catalog ID
STK684746
SMILES CN(CCC1CCN(CC1)c1cc(C#N)c(cc1[N+](=O)[O-])C#N)C

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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 C17H21N5O2 MW 327.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O2/c1-20(2)6-3-13-4-7-21(8-5-13)16-9-14(11-18)15(12-19)10-17(16)22(23)24/h9-10,13H,3-8H2,1-2H3
InChIKey
BGLGTUKDARGOME-UHFFFAOYSA-N
Synonyms

4(4(2(dimethylamino)ethyl)piperidin1yl)5nitrobenzene12dicarbonitrile
4(4(2(DIMETHYLAMINO)ETHYL)PIPERIDIN1YL)5NITROPHTHALONITRILE
4(4(2DIMETHYLAMINOETHYL)PIPERIDIN1YL)5NITROBENZENE12DICARBONITRILE
CN(C)CCC1CCN(CC1)C2=C(C=C(C(=C2)C#N)C#N)(N+)(=O)(O)
CN(CCC1CCN(CC1)c1cc(C#N)c(cc1(N+)(=O)(O))C#N)C
InChI=1SC17H21N5O2c120(2)63134721(8513)16914(1118)15(1219)1017(16)22(23)24h91013H38H212H3
MFCD05855969
ZINC000004628951
ZINC4628951

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Available files

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