Vitas-M small molecule compound
6-(5-nitrofuran-2-yl)-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL300360
SMILES [O-][N+](=O)c1ccc(o1)c1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3
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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 C17H17N5O3S MW 371.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17N5O3S/c23-22(24)13-2-1-12(25-13)14-20-21-15(18-19-16(21)26-14)17-6-9-3-10(7-17)5-11(4-9)8-17/h1-2,9-11H,3-8H2InChIKey
IHTWGVNLTADFAE-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(o1)c1nn2c(s1)nnc2C12CC3CC(C2)CC(C1)C3
3(1ADAMANTYL)6(5NITRO2FURYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(1adamantyl)6(5nitrofuran2yl)(124)triazolo(34b)(134)thiadiazole
6(5nitrofuran2yl)3(tricyclo(3311~37~)dec1yl)(124)triazolo(34b)(134)thiadiazole
C1C2CC3CC1CC(C2)(C3)C4=NN=C5N4N=C(S5)C6=CC=C(O6)(N+)(=O)(O)
InChI=1SC17H17N5O3Sc2322(24)132112(2513)14202115(181916(21)2614)1769310(717)511(49)817h12911H38H2
ZINC000095471834
ZINC95471834
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