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2-[2-(6-Amino-4-(4-bromophenyl)-5-cyano-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl)-2-oxoethoxy]benzamide
SpectraBase Compound ID 3rjyTXn5DFb
InChI InChI=1S/C23H18BrN5O4/c1-12-19-20(13-6-8-14(24)9-7-13)16(10-25)22(27)33-23(19)29(28-12)18(30)11-32-17-5-3-2-4-15(17)21(26)31/h2-9,20H,11,27H2,1H3,(H2,26,31)
InChIKey PNAPNSBSWGSHTF-UHFFFAOYSA-N
Mol Weight 508.33 g/mol
Molecular Formula C23H18BrN5O4
Exact Mass 507.054217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DE3yXyu1qyT
Name 2-[2-(6-Amino-4-(4-bromophenyl)-5-cyano-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl)-2-oxoethoxy]benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H18BrN5O4
InChI InChI=1S/C23H18BrN5O4/c1-12-19-20(13-6-8-14(24)9-7-13)16(10-25)22(27)33-23(19)29(28-12)18(30)11-32-17-5-3-2-4-15(17)21(26)31/h2-9,20H,11,27H2,1H3,(H2,26,31)
InChIKey PNAPNSBSWGSHTF-UHFFFAOYSA-N
Molecular Weight 508.332 g/mol
SMILES NC1=C(C(c2c([n](C(COc3c(C(=O)N)cccc3)=O)nc2C)O1)c1ccc(cc1)Br)C#N
SPLASH splash10-03di-9100000000-69488fd0ed027be7189e
Source of Spectrum Y-51-456-4b
Synonyms 2-(2-(6-amino-4-(4-bromophenyl)-5-cyano-3-methylpyrano[2,3-c]pyrazol-1(4H)-yl)-2-oxoethoxy)benzamide
Wiley ID 1741273