Vitas-M small molecule compound
N-(2,1,3-benzothiadiazol-4-ylcarbamothioyl)-4-nitrobenzamide
Catalog ID
STL495638
SMILES O=C(c1ccc(cc1)[N+](=O)[O-])NC(=S)Nc1cccc2c1nsn2
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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 C14H9N5O3S2 MW 359.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N5O3S2/c20-13(8-4-6-9(7-5-8)19(21)22)16-14(23)15-10-2-1-3-11-12(10)18-24-17-11/h1-7H,(H2,15,16,20,23)InChIKey
WJUZMJJPJJOMJI-UHFFFAOYSA-NSynonyms
C1=CC2=NSN=C2C(=C1)NC(=S)NC(=O)C3=CC=C(C=C3)(N+)(=O)(O)
InChI=1SC14H9N5O3S2c2013(8469(758)19(21)22)1614(23)15102131112(10)18241711h17H(H215162023)
MFCD02802674
N(213benzothiadiazol4ylcarbamothioyl)4nitrobenzamide
O=C(c1ccc(cc1)(N+)(=O)(O))NC(=S)Nc1cccc2c1nsn2
ZINC000005716570
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