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

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5-amino-N-methyl-3-morpholino-N-[(3,4,5-trimethoxybenzylidene)amino]-1,2,4-triazole-1-carbothioamide
SpectraBase Compound ID L1JsGKT6AQy
InChI InChI=1S/C18H25N7O4S/c1-23(20-11-12-9-13(26-2)15(28-4)14(10-12)27-3)18(30)25-16(19)21-17(22-25)24-5-7-29-8-6-24/h9-11H,5-8H2,1-4H3,(H2,19,21,22)/b20-11+
InChIKey UQBXMGOIPDAFPX-RGVLZGJSSA-N
Mol Weight 435.5 g/mol
Molecular Formula C18H25N7O4S
Exact Mass 435.168873 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DEDl2lhwDon
Name 5-amino-N-methyl-3-morpholino-N-[(3,4,5-trimethoxybenzylidene)amino]-1,2,4-triazole-1-carbothioamide
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25N7O4S
InChI InChI=1S/C18H25N7O4S/c1-23(20-11-12-9-13(26-2)15(28-4)14(10-12)27-3)18(30)25-16(19)21-17(22-25)24-5-7-29-8-6-24/h9-11H,5-8H2,1-4H3,(H2,19,21,22)/b20-11+
InChIKey UQBXMGOIPDAFPX-RGVLZGJSSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2007)
Molecular Weight 435.501 g/mol
Source File Reference MHKO16241