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(3-amino-6-isobutylthieno[2,3-b]pyridin-2-yl)(9H-fluoren-2-yl)methanone

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(3-amino-6-isobutylthieno[2,3-b]pyridin-2-yl)(9H-fluoren-2-yl)methanone
SpectraBase Compound ID KWa6znc6K0I
InChI InChI=1S/C25H22N2OS/c1-14(2)11-18-8-10-21-22(26)24(29-25(21)27-18)23(28)16-7-9-20-17(13-16)12-15-5-3-4-6-19(15)20/h3-10,13-14H,11-12,26H2,1-2H3
InChIKey BDDMKCMTQQMDOH-UHFFFAOYSA-N
Mol Weight 398.52 g/mol
Molecular Formula C25H22N2OS
Exact Mass 398.145285 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HkAwp98Y5gQ
Name (3-Amino-6-isobutylthieno[2,3-B]pyridin-2-yl)(9H-fluoren-2-yl)methanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 398.145284509 u
Formula C25H22N2OS
InChI InChI=1S/C25H22N2OS/c1-14(2)11-18-8-10-21-22(26)24(29-25(21)27-18)23(28)16-7-9-20-17(13-16)12-15-5-3-4-6-19(15)20/h3-10,13-14H,11-12,26H2,1-2H3
InChIKey BDDMKCMTQQMDOH-UHFFFAOYSA-N
Molecular Weight 398.524 g/mol
SMILES NC1=C(SC=2N=C(CC(C)C)C=CC12)C(C1=CC=2CC=3C=CC=CC3C2C=C1)=O