Vitas-M small molecule compound
4-{[(E)-(5-bromo-2-methoxyphenyl)methylidene]amino}-5-(4-methylphenyl)-4H-1,2,4-triazole-3-thiol
Catalog ID
STK506471
SMILES COc1ccc(cc1/C=N/n1c(S)nnc1c1ccc(cc1)C)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 C17H15BrN4OS MW 403.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15BrN4OS/c1-11-3-5-12(6-4-11)16-20-21-17(24)22(16)19-10-13-9-14(18)7-8-15(13)23-2/h3-10H,1-2H3,(H,21,24)/b19-10+InChIKey
DUGKZXRSFRKBIQ-VXLYETTFSA-NSynonyms
353780-49-1(E)4((5bromo2methoxybenzylidene)amino)5(ptolyl)4H124triazole3thiol
4(((E)(5bromo2methoxyphenyl)methylidene)amino)5(4methylphenyl)4H124triazole3thiol
4((E)(5BROMO2METHOXYPHENYL)METHYLIDENEAMINO)3(4METHYLPHENYL)1H124TRIAZOLE5THIONE
CC1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=C(C=CC(=C3)Br)OC
COc1ccc(cc1C=Nn1c(S)nnc1c1ccc(cc1)C)Br
InChI=1SC17H15BrN4OSc1113512(6411)16202117(24)22(16)191013914(18)7815(13)232h310H12H3(H2124)b1910+
MFCD01020038
ZINC000001473703
ZINC06032848
ZINC6032848
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