Vitas-M small molecule compound
N-[3-(3-ethyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-methyl-3-nitrobenzamide
Catalog ID
STK247972
SMILES CCc1nnc2n1nc(s2)c1cccc(c1)NC(=O)c1cccc(c1C)[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 C19H16N6O3S MW 408.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N6O3S/c1-3-16-21-22-19-24(16)23-18(29-19)12-6-4-7-13(10-12)20-17(26)14-8-5-9-15(11(14)2)25(27)28/h4-10H,3H2,1-2H3,(H,20,26)InChIKey
WYJGUXDFBJNZTP-UHFFFAOYSA-NSynonyms
CCC1=NN=C2N1N=C(S2)C3=CC(=CC=C3)NC(=O)C4=C(C(=CC=C4)(N+)(=O)(O))C
CCc1nnc2n1nc(s2)c1cccc(c1)NC(=O)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC19H16N6O3Sc131621221924(16)2318(2919)1264713(1012)2017(26)1485915(11(14)2)25(27)28h410H3H212H3(H2026)
MFCD07176253
N(3(3ethyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)2methyl3nitrobenzamide
ZINC000008071499
ZINC08071499
ZINC8071499
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