Vitas-M small molecule compound

2-{5-[(4-nitrobenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazol-3-yl}pyridine

Catalog ID
STK847419
SMILES [O-][N+](=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccn1

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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 C20H15N5O2S MW 389.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N5O2S/c26-25(27)17-11-9-15(10-12-17)14-28-20-23-22-19(18-8-4-5-13-21-18)24(20)16-6-2-1-3-7-16/h1-13H,14H2
InChIKey
KSVFZMFOBVKAEN-UHFFFAOYSA-N
Synonyms
712282-59-2
(O)(N+)(=O)c1ccc(cc1)CSc1nnc(n1c1ccccc1)c1ccccn1
2(5(((4NITROPHENYL)METHYL)SULFANYL)4PHENYL4H124TRIAZOL3YL)PYRIDINE
2(5((4nitrobenzyl)sulfanyl)4phenyl4H124triazol3yl)pyridine
2(5((4nitrobenzyl)thio)4phenyl4H124triazol3yl)pyridine
2(5((4NITROPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOL3YL)PYRIDINE
3((4NITROPHENYL)METHYLTHIO)4PHENYL5(2PYRIDYL)124TRIAZOLE
712282592
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=N4
InChI=1SC20H15N5O2Sc2625(27)1711915(101217)142820232219(18845132118)24(20)166213716h113H14H2
MFCD05997399
ZINC000002334668
ZINC02334668
ZINC2334668

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Available files

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