Vitas-M small molecule compound
N-{[2-chloro-5-(trifluoromethyl)phenyl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STL381048
SMILES S=C(Nc1cc(ccc1Cl)C(F)(F)F)NC(=O)c1cccc(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 C15H9ClF3N3O3S MW 403.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9ClF3N3O3S/c16-11-5-4-9(15(17,18)19)7-12(11)20-14(26)21-13(23)8-2-1-3-10(6-8)22(24)25/h1-7H,(H2,20,21,23,26)InChIKey
KWOJRTPZWQLUCJ-UHFFFAOYSA-NSynonyms
C1=CC(=CC(=C1)(N+)(=O)(O))C(=O)NC(=S)NC2=C(C=CC(=C2)C(F)(F)F)Cl
InChI=1SC15H9ClF3N3O3Sc1611549(15(1718)19)712(11)2014(26)2113(23)821310(68)22(24)25h17H(H220212326)
MFCD02920457
N((2chloro5(trifluoromethyl)phenyl)carbamothioyl)3nitrobenzamide
S=C(Nc1cc(ccc1Cl)C(F)(F)F)NC(=O)c1cccc(c1)(N+)(=O)(O)
ZINC000006511816
ZINC06511816
ZINC6511816
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