Vitas-M small molecule compound

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

Catalog ID
STL352373
SMILES Cc1ccc(cc1)c1nnc(n1c1ccccc1)SCc1cccc(c1)Br

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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/c1-16-10-12-18(13-11-16)21-24-25-22(26(21)20-8-3-2-4-9-20)27-15-17-6-5-7-19(23)14-17/h2-14H,15H2,1H3
InChIKey
NMMAXEORFXXGQD-UHFFFAOYSA-N
Synonyms
861633-91-2
3((3bromobenzyl)sulfanyl)5(4methylphenyl)4phenyl4H124triazole
3((3bromobenzyl)thio)4phenyl5(ptolyl)4H124triazole
3((3BROMOPHENYL)METHYLSULFANYL)5(4METHYLPHENYL)4PHENYL124TRIAZOLE
3((3BROMOPHENYL)METHYLTHIO)5(4METHYLPHENYL)4PHENYL124TRIAZOLE
861633912
CC1=CC=C(C=C1)C2=NN=C(N2C3=CC=CC=C3)SCC4=CC(=CC=C4)Br
InChI=1SC22H18BrN3Sc116101218(131116)21242522(26(21)208324920)27151765719(23)1417h214H15H21H3
MFCD01431088
ZINC000009309009
ZINC09309009
ZINC9309009

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Available files

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