Vitas-M small molecule compound
4-{[(E)-(3-bromophenyl)methylidene]amino}-5-[3-(propan-2-yloxy)phenyl]-4H-1,2,4-triazole-3-thiol
Catalog ID
STL054418
SMILES CC(Oc1cccc(c1)c1nnc(n1/N=C/c1cccc(c1)Br)S)C
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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 C18H17BrN4OS MW 417.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17BrN4OS/c1-12(2)24-16-8-4-6-14(10-16)17-21-22-18(25)23(17)20-11-13-5-3-7-15(19)9-13/h3-12H,1-2H3,(H,22,25)/b20-11+InChIKey
YTPZALDWOLQMAV-RGVLZGJSSA-NSynonyms
678558-87-7(E)4((3bromobenzylidene)amino)5(3isopropoxyphenyl)4H124triazole3thiol
4(((E)(3bromophenyl)methylidene)amino)5(3(propan2yloxy)phenyl)4H124triazole3thiol
4((1E)2(3BROMOPHENYL)1AZAVINYL)5(3(METHYLETHOXY)PHENYL)124TRIAZOLE3THIOL
4((E)(3BROMOPHENYL)METHYLIDENEAMINO)3(3PROPAN2YLOXYPHENYL)1H124TRIAZOLE5THIONE
678558877
CC(C)OC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=CC(=CC=C3)Br
CC(Oc1cccc(c1)c1nnc(n1N=Cc1cccc(c1)Br)S)C
InChI=1SC18H17BrN4OSc112(2)241684614(1016)17212218(25)23(17)20111353715(19)913h312H12H3(H2225)b2011+
MFCD04011623
ZINC000009331666
ZINC33364746
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