Vitas-M small molecule compound

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

Catalog ID
STL019531
SMILES [O-][N+](=O)c1ccc(cc1)c1nn2c(s1)nnc2CCc1ccccc1

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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 C17H13N5O2S MW 351.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H13N5O2S/c23-22(24)14-9-7-13(8-10-14)16-20-21-15(18-19-17(21)25-16)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2
InChIKey
SDDRRDRLMMPRSD-UHFFFAOYSA-N
Synonyms

(O)(N+)(=O)c1ccc(cc1)c1nn2c(s1)nnc2CCc1ccccc1
6(4nitrophenyl)3(2phenylethyl)(124)triazolo(34b)(134)thiadiazole
6(4NITROPHENYL)3(2PHENYLETHYL)124TRIAZOLO(34B)134THIADIAZOLINE
6(4NITROPHENYL)3PHENETHYL(124)TRIAZOLO(34B)(134)THIADIAZOLE
C1=CC=C(C=C1)CCC2=NN=C3N2N=C(S3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC17H13N5O2Sc2322(24)149713(81014)16202115(181917(21)2516)116124213512h15710H611H2
MFCD06438934
ZINC000004866759
ZINC04866759
ZINC4866759

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Available files

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