Vitas-M small molecule compound
3-cyclohexyl-6-(4-nitrophenyl)-7H-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazine
Catalog ID
STK847254
SMILES [O-][N+](=O)c1ccc(cc1)C1=Nn2c(SC1)nnc2C1CCCCC1
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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 C16H17N5O2S MW 343.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N5O2S/c22-21(23)13-8-6-11(7-9-13)14-10-24-16-18-17-15(20(16)19-14)12-4-2-1-3-5-12/h6-9,12H,1-5,10H2InChIKey
LSEDWHWSEFIFIR-UHFFFAOYSA-NSynonyms
714236-40-5(O)(N+)(=O)c1ccc(cc1)C1=Nn2c(SC1)nnc2C1CCCCC1
3cyclohexyl6(4nitrophenyl)7H(124)triazolo(34b)(134)thiadiazine
3CYCLOHEXYL6(4NITROPHENYL)7H124TRIAZOLO(34B)134THIADIAZINE
714236405
C1CCC(CC1)C2=NN=C3N2N=C(CS3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC16H17N5O2Sc2221(23)138611(7913)14102416181715(20(16)1914)124213512h6912H1510H2
MFCD05705730
ZINC000001315529
ZINC01315529
ZINC1315529
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