Vitas-M small molecule compound

N-[(2-fluoro-5-nitrophenyl)carbamothioyl]-3-methoxynaphthalene-2-carboxamide

Catalog ID
STK088357
SMILES COc1cc2ccccc2cc1C(=O)NC(=S)Nc1cc(ccc1F)[N+](=O)[O-]

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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 C19H14FN3O4S MW 399.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14FN3O4S/c1-27-17-9-12-5-3-2-4-11(12)8-14(17)18(24)22-19(28)21-16-10-13(23(25)26)6-7-15(16)20/h2-10H,1H3,(H2,21,22,24,28)
InChIKey
RKCTYQZKIWJOPH-UHFFFAOYSA-N
Synonyms

COC1=CC2=CC=CC=C2C=C1C(=O)NC(=S)NC3=C(C=CC(=C3)(N+)(=O)(O))F
COc1cc2ccccc2cc1C(=O)NC(=S)Nc1cc(ccc1F)(N+)(=O)(O)
InChI=1SC19H14FN3O4Sc12717912532411(12)814(17)18(24)2219(28)21161013(23(25)26)6715(16)20h210H1H3(H221222428)
MFCD03032290
N((2FLUORO5NITROPHENYL)CARBAMOTHIOYL)3METHOXYNAPHTHALENE2CARBOXAMIDE
STK088357
ZINC000001178516
ZINC01178516
ZINC1178516

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Available files

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