Vitas-M small molecule compound

2-nitro-N-(pyridin-3-ylcarbamothioyl)benzamide

Catalog ID
STK012885
SMILES S=C(NC(=O)c1ccccc1[N+](=O)[O-])Nc1cccnc1

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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 C13H10N4O3S MW 302.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N4O3S/c18-12(10-5-1-2-6-11(10)17(19)20)16-13(21)15-9-4-3-7-14-8-9/h1-8H,(H2,15,16,18,21)
InChIKey
HWTNKQDJSPZLEU-UHFFFAOYSA-N
Synonyms

2NITRON(PYRIDIN3YLCARBAMOTHIOYL)BENZAMIDE
C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CN=CC=C2)(N+)(=O)(O)
InChI=1SC13H10N4O3Sc1812(10512611(10)17(19)20)1613(21)1594371489h18H(H215161821)
MFCD02821664
S=C(NC(=O)c1ccccc1(N+)(=O)(O))Nc1cccnc1
STK012885
ZINC000000454414
ZINC00454414
ZINC454414

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Available files

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