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3-amino-N-(2,6-dichlorophenyl)-4,6-dimethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide

View entire compound with spectra: 2 NMR

3-amino-N-(2,6-dichlorophenyl)-4,6-dimethyl-N-phenylthieno[2,3-b]pyridine-2-carboxamide
SpectraBase Compound ID 6hWcf2ohqw2
InChI InChI=1S/C22H17Cl2N3OS/c1-12-11-13(2)26-21-17(12)18(25)20(29-21)22(28)27(14-7-4-3-5-8-14)19-15(23)9-6-10-16(19)24/h3-11H,25H2,1-2H3
InChIKey YCRWRZRYXIGNRT-UHFFFAOYSA-N
Mol Weight 442.36 g/mol
Molecular Formula C22H17Cl2N3OS
Exact Mass 441.046939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Jf2tExdkRxJ
Name 3-Amino-N-(2,6-dichlorophenyl)-4,6-dimethyl-N-phenylthieno[2,3-B]pyridine-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 441.046938752 u
Formula C22H17Cl2N3OS
InChI InChI=1S/C22H17Cl2N3OS/c1-12-11-13(2)26-21-17(12)18(25)20(29-21)22(28)27(14-7-4-3-5-8-14)19-15(23)9-6-10-16(19)24/h3-11H,25H2,1-2H3
InChIKey YCRWRZRYXIGNRT-UHFFFAOYSA-N
Molecular Weight 442.364 g/mol
SMILES NC1=C(C(N(C2=C(Cl)C=CC=C2Cl)C=2C=CC=CC2)=O)SC=2N=C(C)C=C(C12)C