Vitas-M small molecule compound

3-(1-benzofuran-2-yl)-5-[(3-bromo-4-methoxybenzyl)sulfanyl]-4-phenyl-4H-1,2,4-triazole

Catalog ID
STK654737
SMILES COc1ccc(cc1Br)CSc1nnc(n1c1ccccc1)c1cc2c(o1)cccc2

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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 C24H18BrN3O2S MW 492.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H18BrN3O2S/c1-29-21-12-11-16(13-19(21)25)15-31-24-27-26-23(28(24)18-8-3-2-4-9-18)22-14-17-7-5-6-10-20(17)30-22/h2-14H,15H2,1H3
InChIKey
SGEDHEMDUHSNPJ-UHFFFAOYSA-N
Synonyms
840496-60-8
3(1benzofuran2yl)5((3bromo4methoxybenzyl)sulfanyl)4phenyl4H124triazole
3(1BENZOFURAN2YL)5((3BROMO4METHOXYPHENYL)METHYLSULFANYL)4PHENYL124TRIAZOLE
3(benzofuran2yl)5((3bromo4methoxybenzyl)thio)4phenyl4H124triazole
840496608
COC1=C(C=C(C=C1)CSC2=NN=C(N2C3=CC=CC=C3)C4=CC5=CC=CC=C5O4)Br
InChI=1SC24H18BrN3O2Sc12921121116(1319(21)25)153124272623(28(24)188324918)2214177561020(17)3022h214H15H21H3
MFCD04008221
ZINC000009463823
ZINC09463823
ZINC9463823

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Available files

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