Vitas-M small molecule compound

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

Catalog ID
STK644811
SMILES [O-][N+](=O)c1cccc(c1)c1nn2c(s1)nnc2Cc1ccccc1

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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/c22-21(23)13-8-4-7-12(10-13)15-19-20-14(17-18-16(20)24-15)9-11-5-2-1-3-6-11/h1-8,10H,9H2
InChIKey
IOGAAMUJMLUXIJ-UHFFFAOYSA-N
Synonyms
496842-83-2
(O)(N+)(=O)c1cccc(c1)c1nn2c(s1)nnc2Cc1ccccc1
3benzyl6(3nitrophenyl)(124)triazolo(34b)(134)thiadiazole
496842832
C1=CC=C(C=C1)CC2=NN=C3N2N=C(S3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC16H11N5O2Sc2221(23)1384712(1013)15192014(171816(20)2415)9115213611h1810H9H2
MFCD09856813
ZINC000013727881
ZINC13727881

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Available files

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