Vitas-M small molecule compound
N-{[2-(ethylcarbamoyl)phenyl]carbamothioyl}-3,5-dinitrobenzamide
Catalog ID
STL065113
SMILES CCNC(=O)c1ccccc1NC(=S)NC(=O)c1cc(cc(c1)[N+](=O)[O-])[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 C17H15N5O6S MW 417.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15N5O6S/c1-2-18-16(24)13-5-3-4-6-14(13)19-17(29)20-15(23)10-7-11(21(25)26)9-12(8-10)22(27)28/h3-9H,2H2,1H3,(H,18,24)(H2,19,20,23,29)InChIKey
RIJLUONJYADGIS-UHFFFAOYSA-NSynonyms
CCNC(=O)C1=CC=CC=C1NC(=S)NC(=O)C2=CC(=CC(=C2)(N+)(=O)(O))(N+)(=O)(O)
CCNC(=O)c1ccccc1NC(=S)NC(=O)c1cc(cc(c1)(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC17H15N5O6Sc121816(24)13534614(13)1917(29)2015(23)10711(21(25)26)912(810)22(27)28h39H2H21H3(H1824)(H219202329)
MFCD05881284
N((2(ethylcarbamoyl)phenyl)carbamothioyl)35dinitrobenzamide
ZINC000012137459
ZINC12137459
Check stock
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Check stock on Vitas-MAvailable files
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