5-amino-N-methyl-3-(methylthio)-N-[(3-nitrobenzylidene)amino]-1,2,4-triazole-1-carbothioamide

SpectraBase Compound ID	8TMLN3yWIDj
InChI	InChI=1S/C12H13N7O2S2/c1-17(12(22)18-10(13)15-11(16-18)23-2)14-7-8-4-3-5-9(6-8)19(20)21/h3-7H,1-2H3,(H2,13,15,16)/b14-7+
InChIKey	DXBNTYBDFSOOKM-VGOFMYFVSA-N Google Search
Mol Weight	351.4 g/mol
Molecular Formula	C12H13N7O2S2
Exact Mass	351.057215 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	I8CXAT4vFyu
Name	5-amino-N-methyl-3-(methylthio)-N-[(3-nitrobenzylidene)amino]-1,2,4-triazole-1-carbothioamide
Copyright	Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula	C12H13N7O2S2
InChI	InChI=1S/C12H13N7O2S2/c1-17(12(22)18-10(13)15-11(16-18)23-2)14-7-8-4-3-5-9(6-8)19(20)21/h3-7H,1-2H3,(H2,13,15,16)/b14-7+
InChIKey	DXBNTYBDFSOOKM-VGOFMYFVSA-N
Literature Reference Author	ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation	UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight	351.401 g/mol
Source File Reference	MHKO16245