Vitas-M small molecule compound
2-{4-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Catalog ID
STK569830
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccccn1
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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 C21H17N5O3S MW 419.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N5O3S/c1-29-18-11-9-16(10-12-18)25-20(19-4-2-3-13-22-19)23-24-21(25)30-14-15-5-7-17(8-6-15)26(27)28/h2-13H,14H2,1H3InChIKey
BGMBJHKIFLOQBF-UHFFFAOYSA-NSynonyms
879449-54-42(4(4METHOXYPHENYL)5(((4NITROPHENYL)METHYL)SULFANYL)4H124TRIAZOL3YL)PYRIDINE
2(4(4methoxyphenyl)5((4nitrobenzyl)sulfanyl)4H124triazol3yl)pyridine
2(4(4methoxyphenyl)5((4nitrobenzyl)thio)4H124triazol3yl)pyridine
2(4(4METHOXYPHENYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRIDINE
4METHOXY1(3((4NITROPHENYL)METHYLTHIO)5(2PYRIDYL)(124TRIAZOL4YL))BENZENE
879449544
COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=CC=N4
COc1ccc(cc1)n1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1ccccn1
InChI=1SC21H17N5O3Sc1291811916(101218)2520(19423132219)232421(25)3014155717(8615)26(27)28h213H14H21H3
MFCD06610820
ZINC000002351219
ZINC02351219
ZINC2351219
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