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Thieno[2,3-b]pyridine-2-carboxamide, 3-[(2-chlorobenzoyl)amino]-N-(2-furanylmethyl)-4,6-dimethyl-
SpectraBase Compound ID 8GOoMkAtkTj
InChI InChI=1S/C22H18ClN3O3S/c1-12-10-13(2)25-22-17(12)18(26-20(27)15-7-3-4-8-16(15)23)19(30-22)21(28)24-11-14-6-5-9-29-14/h3-10H,11H2,1-2H3,(H,24,28)(H,26,27)
InChIKey LJQVKAUERSLQCK-UHFFFAOYSA-N
Mol Weight 439.92 g/mol
Molecular Formula C22H18ClN3O3S
Exact Mass 439.07574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7SKSU6LPvnY
Name Thieno[2,3-B]pyridine-2-carboxamide, 3-[(2-chlorobenzoyl)amino]-N-(2-furanylmethyl)-4,6-dimethyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 439.075740323 u
Formula C22H18ClN3O3S
InChI InChI=1S/C22H18ClN3O3S/c1-12-10-13(2)25-22-17(12)18(26-20(27)15-7-3-4-8-16(15)23)19(30-22)21(28)24-11-14-6-5-9-29-14/h3-10H,11H2,1-2H3,(H,24,28)(H,26,27)
InChIKey LJQVKAUERSLQCK-UHFFFAOYSA-N
Molecular Weight 439.917 g/mol
SMILES C1=CC=C(O1)CNC(=O)C1=C(C=2C(=CC(=NC2S1)C)C)NC(=O)C=1C(=CC=CC1)Cl