Vitas-M small molecule compound

3-[5-(benzylsulfanyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]pyridine

Catalog ID
STK550404
SMILES CCOc1ccc(cc1)n1c(SCc2ccccc2)nnc1c1cccnc1

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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 C22H20N4OS MW 388.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4OS/c1-2-27-20-12-10-19(11-13-20)26-21(18-9-6-14-23-15-18)24-25-22(26)28-16-17-7-4-3-5-8-17/h3-15H,2,16H2,1H3
InChIKey
RSGDCMSTLDPCKX-UHFFFAOYSA-N
Synonyms
613227-19-3
3(5(benzylsulfanyl)4(4ethoxyphenyl)4H124triazol3yl)pyridine
3(5(benzylthio)4(4ethoxyphenyl)4H124triazol3yl)pyridine
3(5BENZYLSULFANYL4(4ETHOXYPHENYL)124TRIAZOL3YL)PYRIDINE
4ETHOXY1(3(PHENYLMETHYLTHIO)5(3PYRIDYL)(124TRIAZOL4YL))BENZENE
613227193
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC=CC=C3)C4=CN=CC=C4
InChI=1SC22H20N4OSc122720121019(111320)2621(189614231518)242522(26)2816177435817h315H216H21H3
MFCD03225146
ZINC000001088898
ZINC01088898
ZINC1088898

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Available files

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