Vitas-M small molecule compound

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

Catalog ID
STK584789
SMILES Clc1ccc(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 C21H15BrClN3S MW 456.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrClN3S/c22-17-6-4-5-15(13-17)14-27-21-25-24-20(16-9-11-18(23)12-10-16)26(21)19-7-2-1-3-8-19/h1-13H,14H2
InChIKey
OMWJTLMEXNDHHP-UHFFFAOYSA-N
Synonyms
849006-13-9
3(((3BROMOPHENYL)METHYL)SULFANYL)5(4CHLOROPHENYL)4PHENYL4H124TRIAZOLE
3((3bromobenzyl)sulfanyl)5(4chlorophenyl)4phenyl4H124triazole
3((3bromobenzyl)thio)5(4chlorophenyl)4phenyl4H124triazole
3((3BROMOPHENYL)METHYLSULFANYL)5(4CHLOROPHENYL)4PHENYL124TRIAZOLE
3((3BROMOPHENYL)METHYLTHIO)5(4CHLOROPHENYL)4PHENYL124TRIAZOLE
849006139
C1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)Br)C4=CC=C(C=C4)Cl
InChI=1SC21H15BrClN3Sc221764515(1317)142721252420(1691118(23)121016)26(21)197213819h113H14H2
MFCD01431900
ZINC000002450658
ZINC02450658
ZINC2450658

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Available files

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