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thieno[2,3-b]pyridine-2-carboxamide, 3-amino-N-(3-chloro-2-methylphenyl)-4-(2-furanyl)-6-(4-methylphenyl)-
SpectraBase Compound ID DUwZpHqGLIB
InChI InChI=1S/C26H20ClN3O2S/c1-14-8-10-16(11-9-14)20-13-17(21-7-4-12-32-21)22-23(28)24(33-26(22)30-20)25(31)29-19-6-3-5-18(27)15(19)2/h3-13H,28H2,1-2H3,(H,29,31)
InChIKey GOHHHIVTBGHJHN-UHFFFAOYSA-N
Mol Weight 473.98 g/mol
Molecular Formula C26H20ClN3O2S
Exact Mass 473.096476 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FCd1bojUSZ4
Name Thieno[2,3-B]pyridine-2-carboxamide, 3-amino-N-(3-chloro-2-methylphenyl)-4-(2-furanyl)-6-(4-methylphenyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 473.096475768 u
Formula C26H20ClN3O2S
InChI InChI=1S/C26H20ClN3O2S/c1-14-8-10-16(11-9-14)20-13-17(21-7-4-12-32-21)22-23(28)24(33-26(22)30-20)25(31)29-19-6-3-5-18(27)15(19)2/h3-13H,28H2,1-2H3,(H,29,31)
InChIKey GOHHHIVTBGHJHN-UHFFFAOYSA-N
Molecular Weight 473.978 g/mol
SMILES NC1=C(C(NC2=C(C(Cl)=CC=C2)C)=O)SC=2N=C(C=C(C12)C=1OC=CC1)C1=CC=C(C=C1)C