Vitas-M small molecule compound
3-{4-benzyl-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Catalog ID
STK092108
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1Cc1ccccc1)c1cccnc1
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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 C21H17N5O2S MW 403.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O2S/c27-26(28)19-10-8-17(9-11-19)15-29-21-24-23-20(18-7-4-12-22-13-18)25(21)14-16-5-2-1-3-6-16/h1-13H,14-15H2InChIKey
QJDRCNUHJGLPAI-UHFFFAOYSA-NSynonyms
(O)(N+)(=O)c1ccc(cc1)CSc1nnc(n1Cc1ccccc1)c1cccnc1
3(4BENZYL5((4NITROBENZYL)SULFANYL)4H124TRIAZOL3YL)PYRIDINE
3(4benzyl5((4nitrobenzyl)thio)4H124triazol3yl)pyridine
3(4BENZYL5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRIDINE
C1=CC=C(C=C1)CN2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CN=CC=C4
InChI=1SC21H17N5O2Sc2726(28)1910817(91119)152921242320(187412221318)25(21)14165213616h113H1415H2
MFCD02996461
STK092108
ZINC000001304725
ZINC01304725
ZINC1304725
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