Vitas-M small molecule compound

5-nitro-N,N'-bis(pyridin-3-ylmethyl)benzene-1,3-dicarboxamide

Catalog ID
STK083277
SMILES [O-][N+](=O)c1cc(cc(c1)C(=O)NCc1cccnc1)C(=O)NCc1cccnc1

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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 C20H17N5O4 MW 391.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17N5O4/c26-19(23-12-14-3-1-5-21-10-14)16-7-17(9-18(8-16)25(28)29)20(27)24-13-15-4-2-6-22-11-15/h1-11H,12-13H2,(H,23,26)(H,24,27)
InChIKey
GHVWEHXZTZYIGV-UHFFFAOYSA-N
Synonyms
332116-32-2
(3NITRO5(N(3PYRIDYLMETHYL)CARBAMOYL)PHENYL)N(3PYRIDYLMETHYL)CARBOXAMIDE
(O)(N+)(=O)c1cc(cc(c1)C(=O)NCc1cccnc1)C(=O)NCc1cccnc1
332116322
5NITRO1N3NBIS(PYRIDIN3YLMETHYL)BENZENE13DICARBOXAMIDE
5NITRON1N3BIS(3PYRIDINYLMETHYL)ISOPHTHALAMIDE
5nitroN1N3bis(pyridin3ylmethyl)isophthalamide
5NITRONNBIS(PYRIDIN3YLMETHYL)BENZENE13DICARBOXAMIDE
5NITRONNBISPYRIDIN3YLMETHYLISOPHTHALAMIDE
C1=CC(=CN=C1)CNC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))C(=O)NCC3=CN=CC=C3
InChI=1SC20H17N5O4c2619(231214315211014)16717(918(816)25(28)29)20(27)241315426221115h111H1213H2(H2326)(H2427)
MFCD01465968
STK083277
ZINC000004135499
ZINC04135499
ZINC4135499

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Available files

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