Vitas-M small molecule compound
3-nitro-4-[(phenylsulfonyl)amino]phenyl thiocyanate
Catalog ID
STL358660
SMILES N#CSc1ccc(c(c1)[N+](=O)[O-])NS(=O)(=O)c1ccccc1
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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 C13H9N3O4S2 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N3O4S2/c14-9-21-10-6-7-12(13(8-10)16(17)18)15-22(19,20)11-4-2-1-3-5-11/h1-8,15HInChIKey
PNXCGFSNDBKRCW-UHFFFAOYSA-NSynonyms
(4(benzenesulfonamido)3nitrophenyl)thiocyanate
3nitro4((phenylsulfonyl)amino)phenylthiocyanate
C1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)SC#N)(N+)(=O)(O)
InChI=1SC13H9N3O4S2c14921106712(13(810)16(17)18)1522(1920)114213511h1815H
MFCD28033628
N#CSc1ccc(c(c1)(N+)(=O)(O))NS(=O)(=O)c1ccccc1
ZINC000095471454
ZINC95471454
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