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3-amino-N-(2,3-dichlorophenyl)-4-(4-fluorophenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide

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3-amino-N-(2,3-dichlorophenyl)-4-(4-fluorophenyl)-6-(2-thienyl)thieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID 8WaXAGMu00K
InChI InChI=1S/C24H14Cl2FN3OS2/c25-15-3-1-4-16(20(15)26)29-23(31)22-21(28)19-14(12-6-8-13(27)9-7-12)11-17(30-24(19)33-22)18-5-2-10-32-18/h1-11H,28H2,(H,29,31)
InChIKey KVSIXARTILRFRA-UHFFFAOYSA-N
Mol Weight 514.42 g/mol
Molecular Formula C24H14Cl2FN3OS2
Exact Mass 512.993938 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A3KYe55plfQ
Name 3-Amino-N-(2,3-dichlorophenyl)-4-(4-fluorophenyl)-6-(2-thienyl)thieno[2,3-B]pyridine-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 512.993937993 u
Formula C24H14Cl2FN3OS2
InChI InChI=1S/C24H14Cl2FN3OS2/c25-15-3-1-4-16(20(15)26)29-23(31)22-21(28)19-14(12-6-8-13(27)9-7-12)11-17(30-24(19)33-22)18-5-2-10-32-18/h1-11H,28H2,(H,29,31)
InChIKey KVSIXARTILRFRA-UHFFFAOYSA-N
Molecular Weight 514.420 g/mol
SMILES NC1=C(C(NC2=C(C(Cl)=CC=C2)Cl)=O)SC2=NC(=CC(=C12)C=1C=CC(=CC1)F)C=1SC=CC1