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acetamide, 2-[[4-amino-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-(3-nitrophenyl)-
SpectraBase Compound ID IbJq3klLtYB
InChI InChI=1S/C15H13N7O3S/c16-21-14(10-3-2-6-17-8-10)19-20-15(21)26-9-13(23)18-11-4-1-5-12(7-11)22(24)25/h1-8H,9,16H2,(H,18,23)
InChIKey DJLAJWUVGLMGCG-UHFFFAOYSA-N
Mol Weight 371.38 g/mol
Molecular Formula C15H13N7O3S
Exact Mass 371.080058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JdDMDxBSaGN
Name 2-[(4-amino-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Alternate Name(s) 2-[(4-azanyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-nitrophenyl)ethanamide 2-[[4-amino-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-N-(3-nitrophenyl)acetamide 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-nitrophenyl)acetamide 2-[[4-amino-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(3-nitrophenyl)acetamide
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Formula C15H13N7O3S
InChI InChI=1S/C15H13N7O3S/c16-21-14(10-3-2-6-17-8-10)19-20-15(21)26-9-13(23)18-11-4-1-5-12(7-11)22(24)25/h1-8H,9,16H2,(H,18,23)
InChIKey DJLAJWUVGLMGCG-UHFFFAOYSA-N
Molecular Weight 371.375 g/mol
SMILES N(C(CSc1nnc([n]1N)-c1cnccc1)=O)c1cc(N(=O)=O)ccc1
SPLASH splash10-0pdl-4930000000-46d3b21b2e60d3151bd6
Wiley ID 1452866