Vitas-M small molecule compound

2-methoxy-N-[(3-nitrophenyl)carbamothioyl]benzamide

Catalog ID
STK049399
SMILES COc1ccccc1C(=O)NC(=S)Nc1cccc(c1)[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 C15H13N3O4S MW 331.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13N3O4S/c1-22-13-8-3-2-7-12(13)14(19)17-15(23)16-10-5-4-6-11(9-10)18(20)21/h2-9H,1H3,(H2,16,17,19,23)
InChIKey
DCYPMIMOAYBIQE-UHFFFAOYSA-N
Synonyms

2METHOXYN(((3NITROPHENYL)AMINO)CARBONOTHIOYL)BENZAMIDE
2METHOXYN((3NITROPHENYL)CARBAMOTHIOYL)BENZAMIDE
COC1=CC=CC=C1C(=O)NC(=S)NC2=CC(=CC=C2)(N+)(=O)(O)
COc1ccccc1C(=O)NC(=S)Nc1cccc(c1)(N+)(=O)(O)
InChI=1SC15H13N3O4Sc12213832712(13)14(19)1715(23)161054611(910)18(20)21h29H1H3(H216171923)
MFCD02631584
STK049399
ZINC000000453745
ZINC00453745
ZINC453745

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Available files

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