Vitas-M small molecule compound
6-[5-(2-chloro-4-nitrophenyl)furan-2-yl]-3-(furan-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STK337959
SMILES Clc1cc(ccc1c1ccc(o1)c1nn2c(s1)nnc2c1ccco1)[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 C17H8ClN5O4S MW 413.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H8ClN5O4S/c18-11-8-9(23(24)25)3-4-10(11)12-5-6-14(27-12)16-21-22-15(13-2-1-7-26-13)19-20-17(22)28-16/h1-8HInChIKey
HCNSNHZHDUQMKM-UHFFFAOYSA-NSynonyms
6(5(2chloro4nitrophenyl)furan2yl)3(furan2yl)(124)triazolo(34b)(134)thiadiazole
C1=COC(=C1)C2=NN=C3N2N=C(S3)C4=CC=C(O4)C5=C(C=C(C=C5)(N+)(=O)(O))Cl
Clc1cc(ccc1c1ccc(o1)c1nn2c(s1)nnc2c1ccco1)(N+)(=O)(O)
InChI=1SC17H8ClN5O4Sc181189(23(24)25)3410(11)125614(2712)16212215(132172613)192017(22)2816h18H
MFCD06304835
ZINC000008763567
ZINC08763567
ZINC8763567
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