Vitas-M small molecule compound
3-(4-bromophenyl)-4-(4-methoxyphenyl)-5-phenyl-4H-1,2,4-triazole
Catalog ID
STK759558
SMILES COc1ccc(cc1)n1c(nnc1c1ccc(cc1)Br)c1ccccc1
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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 C21H16BrN3O MW 406.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16BrN3O/c1-26-19-13-11-18(12-14-19)25-20(15-5-3-2-4-6-15)23-24-21(25)16-7-9-17(22)10-8-16/h2-14H,1H3InChIKey
ZPWFNQYLQYDAGI-UHFFFAOYSA-NSynonyms
3(4BROMOPHENYL)4(4METHOXYPHENYL)5PHENYL124TRIAZOLE
3(4BROMOPHENYL)4(4METHOXYPHENYL)5PHENYL4H124TRIAZOLE
COC1=CC=C(C=C1)N2C(=NN=C2C3=CC=C(C=C3)Br)C4=CC=CC=C4
InChI=1SC21H16BrN3Oc12619131118(121419)2520(155324615)232421(25)167917(22)10816h214H1H3
MFCD01443296
ZINC000004498226
ZINC04498226
ZINC4498226
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