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5-Amino-N-[5-(1-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]-1H-pyrazole-4-carboxamide
SpectraBase Compound ID KOkJe05RO7x
InChI InChI=1S/C22H18N8O2/c1-29-12-16(14-9-5-6-10-17(14)29)19(31)18-21(25-22(32)15-11-24-26-20(15)23)28-30(27-18)13-7-3-2-4-8-13/h2-12H,1H3,(H3,23,24,26)(H,25,28,32)
InChIKey NSBJRZZLTITABZ-UHFFFAOYSA-N
Mol Weight 426.44 g/mol
Molecular Formula C22H18N8O2
Exact Mass 426.155272 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID uqY4AeoC75
Name 5-Amino-N-[5-(1-methyl-1H-indole-3-carbonyl)-2-phenyl-2H-1,2,3-triazol-4-yl]-1H-pyrazole-4-carboxamide
Alternate Name(s) 5-amino-N-[5-[(1-methyl-3-indolyl)-oxomethyl]-2-phenyl-4-triazolyl]-1H-pyrazole-4-carboxamide 5-amino-N-[5-(1-methylindole-3-carbonyl)-2-phenyltriazol-4-yl]-1H-pyrazole-4-carboxamide 5-azanyl-N-[5-(1-methylindol-3-yl)carbonyl-2-phenyl-1,2,3-triazol-4-yl]-1H-pyrazole-4-carboxamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N8O2
InChI InChI=1S/C22H18N8O2/c1-29-12-16(14-9-5-6-10-17(14)29)19(31)18-21(25-22(32)15-11-24-26-20(15)23)28-30(27-18)13-7-3-2-4-8-13/h2-12H,1H3,(H3,23,24,26)(H,25,28,32)
InChIKey NSBJRZZLTITABZ-UHFFFAOYSA-N
Molecular Weight 426.440 g/mol
SMILES N(C(c1c([nH]nc1)N)=O)c1c(n[n](-c2ccccc2)n1)C(c1c[n](C)c2c1cccc2)=O
SPLASH splash10-004i-0000900000-2d3a243efe2b4ec4bc11
Source of Spectrum F2-46-1817-9a
Wiley ID 1703989