Vitas-M small molecule compound
4-{4-(4-methoxyphenyl)-5-[(4-nitrobenzyl)sulfanyl]-4H-1,2,4-triazol-3-yl}pyridine
Catalog ID
STK862610
SMILES COc1ccc(cc1)n1c(SCc2ccc(cc2)[N+](=O)[O-])nnc1c1ccncc1
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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/c1-29-19-8-6-17(7-9-19)25-20(16-10-12-22-13-11-16)23-24-21(25)30-14-15-2-4-18(5-3-15)26(27)28/h2-13H,14H2,1H3InChIKey
WGOQKKPWLFBXBR-UHFFFAOYSA-NSynonyms
4(4(4methoxyphenyl)5((4nitrobenzyl)sulfanyl)4H124triazol3yl)pyridine
4(4(4METHOXYPHENYL)5((4NITROPHENYL)METHYLSULFANYL)124TRIAZOL3YL)PYRIDINE
4METHOXY1(3((4NITROPHENYL)METHYLTHIO)5(4PYRIDYL)(124TRIAZOL4YL))BENZENE
COC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=C(C=C3)(N+)(=O)(O))C4=CC=NC=C4
COc1ccc(cc1)n1c(SCc2ccc(cc2)(N+)(=O)(O))nnc1c1ccncc1
InChI=1SC21H17N5O3Sc129198617(7919)2520(16101222131116)232421(25)3014152418(5315)26(27)28h213H14H21H3
MFCD03621156
ZINC000001123298
ZINC01123298
ZINC1123298
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