Vitas-M small molecule compound
3-(furan-2-yl)-6-[1-(4-nitro-1H-pyrazol-1-yl)ethyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL393861
SMILES [O-][N+](=O)c1cnn(c1)C(c1nn2c(s1)nnc2c1ccco1)C
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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 C12H9N7O3S MW 331.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N7O3S/c1-7(17-6-8(5-13-17)19(20)21)11-16-18-10(9-3-2-4-22-9)14-15-12(18)23-11/h2-7H,1H3InChIKey
IAVPKUBTFHDSPT-UHFFFAOYSA-NSynonyms
1006994-77-9(O)(N+)(=O)c1cnn(c1)C(c1nn2c(s1)nnc2c1ccco1)C
1006994779
3(FURAN2YL)6(1(4NITRO1HPYRAZOL1YL)ETHYL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
3(furan2yl)6(1(4nitropyrazol1yl)ethyl)(124)triazolo(34b)(134)thiadiazole
CC(C1=NN2C(=NN=C2S1)C3=CC=CO3)N4C=C(C=N4)(N+)(=O)(O)
InChI=1SC12H9N7O3Sc17(1768(51317)19(20)21)11161810(9324229)141512(18)2311h27H1H3
MFCD08557432
ZINC000020606310
ZINC000020606311
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