Vitas-M small molecule compound

5-({[5-benzyl-4-(4-fluorophenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-3-(2-methoxyphenyl)-1,2,4-oxadiazole

Catalog ID
STL415560
SMILES COc1ccccc1c1noc(n1)CSc1nnc(n1c1ccc(cc1)F)Cc1ccccc1

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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 C25H20FN5O2S MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN5O2S/c1-32-21-10-6-5-9-20(21)24-27-23(33-30-24)16-34-25-29-28-22(15-17-7-3-2-4-8-17)31(25)19-13-11-18(26)12-14-19/h2-14H,15-16H2,1H3
InChIKey
XXILKSWFJRDBMH-UHFFFAOYSA-N
Synonyms
891056-56-7
5(((5benzyl4(4fluorophenyl)4H124triazol3yl)sulfanyl)methyl)3(2methoxyphenyl)124oxadiazole
5((5benzyl4(4fluorophenyl)124triazol3yl)sulfanylmethyl)3(2methoxyphenyl)124oxadiazole
891056567
COC1=CC=CC=C1C2=NOC(=N2)CSC3=NN=C(N3C4=CC=C(C=C4)F)CC5=CC=CC=C5
InChI=1SC25H20FN5O2Sc132211065920(21)242723(333024)163425292822(15177324817)31(25)19131118(26)121419h214H1516H21H3
MFCD08500846
ZINC000009185030
ZINC09185030
ZINC9185030

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Available files

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