Vitas-M small molecule compound
6-[(5-methyl-4-nitro-1H-pyrazol-1-yl)methyl]-3-(thiophen-2-yl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Catalog ID
STL392956
SMILES [O-][N+](=O)c1cnn(c1C)Cc1nn2c(s1)nnc2c1cccs1
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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 C12H9N7O2S2 MW 347.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9N7O2S2/c1-7-8(19(20)21)5-13-17(7)6-10-16-18-11(9-3-2-4-22-9)14-15-12(18)23-10/h2-5H,6H2,1H3InChIKey
WSPWENUPLODFMO-UHFFFAOYSA-NSynonyms
1020724-75-7(O)(N+)(=O)c1cnn(c1C)Cc1nn2c(s1)nnc2c1cccs1
1020724757
6((5METHYL4NITRO1HPYRAZOL1YL)METHYL)3(THIOPHEN2YL)(124)TRIAZOLO(34B)(134)THIADIAZOLE
6((5methyl4nitropyrazol1yl)methyl)3thiophen2yl(124)triazolo(34b)(134)thiadiazole
CC1=C(C=NN1CC2=NN3C(=NN=C3S2)C4=CC=CS4)(N+)(=O)(O)
InChI=1SC12H9N7O2S2c178(19(20)21)51317(7)610161811(9324229)141512(18)2310h25H6H21H3
MFCD08558521
ZINC000020606985
ZINC20606985
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