Vitas-M small molecule compound
3-[(4-fluorophenoxy)methyl]-6-(2-methyl-3-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK242377
SMILES Fc1ccc(cc1)OCc1nnc2n1nc(s2)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 C17H12FN5O3S MW 385.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H12FN5O3S/c1-10-13(3-2-4-14(10)23(24)25)16-21-22-15(19-20-17(22)27-16)9-26-12-7-5-11(18)6-8-12/h2-8H,9H2,1H3InChIKey
MIKOIQSGKNRHFN-UHFFFAOYSA-NSynonyms
3((4fluorophenoxy)methyl)6(2methyl3nitrophenyl)(124)triazolo(34b)(134)thiadiazole
CC1=C(C=CC=C1(N+)(=O)(O))C2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)F
Fc1ccc(cc1)OCc1nnc2n1nc(s2)c1cccc(c1C)(N+)(=O)(O)
InChI=1SC17H12FN5O3Sc11013(32414(10)23(24)25)16212215(192017(22)2716)926127511(18)6812h28H9H21H3
MFCD08684107
ZINC000008393356
ZINC08393356
ZINC8393356
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