Vitas-M small molecule compound
3-[(2E)-2-(3-bromobenzylidene)hydrazinyl]-5-(prop-2-en-1-ylsulfanyl)-4H-1,2,4-triazole
Catalog ID
STL168469
SMILES C=CCSc1nnc([nH]1)N/N=C/c1cccc(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 C12H12BrN5S MW 338.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12BrN5S/c1-2-6-19-12-15-11(17-18-12)16-14-8-9-4-3-5-10(13)7-9/h2-5,7-8H,1,6H2,(H2,15,16,17,18)/b14-8+InChIKey
PWBYWERIVIYEHD-RIYZIHGNSA-NSynonyms
827591-86-63((2E)2(3bromobenzylidene)hydrazinyl)5(prop2en1ylsulfanyl)4H124triazole
827591866
C=CCSC1=NNC(=N1)NN=CC2=CC(=CC=C2)Br
C=CCSc1nnc((nH)1)NN=Cc1cccc(c1)Br
InChI=1SC12H12BrN5Sc12619121511(171812)16148943510(13)79h2578H16H2(H215161718)b148+
MFCD03345690
N((E)(3bromophenyl)methylideneamino)3prop2enylsulfanyl1H124triazol5amine
ZINC000006856153
ZINC35666790
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