Vitas-M small molecule compound

3-[(3-bromobenzyl)sulfanyl]-4-(4-methylphenyl)-5-phenyl-4H-1,2,4-triazole

Catalog ID
STL298791
SMILES Cc1ccc(cc1)n1c(SCc2cccc(c2)Br)nnc1c1ccccc1

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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 C22H18BrN3S MW 436.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18BrN3S/c1-16-10-12-20(13-11-16)26-21(18-7-3-2-4-8-18)24-25-22(26)27-15-17-6-5-9-19(23)14-17/h2-14H,15H2,1H3
InChIKey
CSPQMRHTCBRTPV-UHFFFAOYSA-N
Synonyms
861116-86-1
3(((3BROMOPHENYL)METHYL)SULFANYL)4(4METHYLPHENYL)5PHENYL4H124TRIAZOLE
3((3bromobenzyl)sulfanyl)4(4methylphenyl)5phenyl4H124triazole
3((3bromobenzyl)thio)5phenyl4(ptolyl)4H124triazole
3((3BROMOPHENYL)METHYLSULFANYL)4(4METHYLPHENYL)5PHENYL124TRIAZOLE
3((3BROMOPHENYL)METHYLTHIO)4(4METHYLPHENYL)5PHENYL124TRIAZOLE
861116861
CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)Br)C4=CC=CC=C4
InChI=1SC22H18BrN3Sc116101220(131116)2621(187324818)242522(26)27151765919(23)1417h214H15H21H3
MFCD05600622
ZINC000009307531
ZINC09307531
ZINC9307531

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Available files

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