Vitas-M small molecule compound

3-(2-methylphenyl)-6-(3-nitrophenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK708313
SMILES Cc1ccccc1c1nnc2n1nc(s2)c1cccc(c1)[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 C16H11N5O2S MW 337.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11N5O2S/c1-10-5-2-3-8-13(10)14-17-18-16-20(14)19-15(24-16)11-6-4-7-12(9-11)21(22)23/h2-9H,1H3
InChIKey
DBBVSTBALARHEI-UHFFFAOYSA-N
Synonyms
951945-31-6
3(2methylphenyl)6(3nitrophenyl)(124)triazolo(34b)(134)thiadiazole
6(3nitrophenyl)3(otolyl)(124)triazolo(34b)(134)thiadiazole
951945316
CC1=CC=CC=C1C2=NN=C3N2N=C(S3)C4=CC(=CC=C4)(N+)(=O)(O)
Cc1ccccc1c1nnc2n1nc(s2)c1cccc(c1)(N+)(=O)(O)
InChI=1SC16H11N5O2Sc110523813(10)1417181620(14)1915(2416)1164712(911)21(22)23h29H1H3
MFCD09855516
ZINC000008392745
ZINC08392745
ZINC8392745

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Available files

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