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5-Bromanyl-N-[(Z)-1-(furan-2-yl)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide
SpectraBase Compound ID I8alUewDqDm
InChI InChI=1S/C23H20BrN3O4/c1-14-16(17-6-2-3-7-18(17)26-14)10-11-25-22(28)19(13-15-5-4-12-30-15)27-23(29)20-8-9-21(24)31-20/h2-9,12-13,26H,10-11H2,1H3,(H,25,28)(H,27,29)/b19-13-
InChIKey BBRRHZVRTIMQCP-UYRXBGFRSA-N
Mol Weight 482.33 g/mol
Molecular Formula C23H20BrN3O4
Exact Mass 481.063719 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HEfBX7q4ryN
Name 5-Bromanyl-N-[(Z)-1-(furan-2-yl)-3-[2-(2-methyl-1H-indol-3-yl)ethylamino]-3-oxidanylidene-prop-1-en-2-yl]furan-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 481.063719132 u
Formula C23H20BrN3O4
InChI InChI=1S/C23H20BrN3O4/c1-14-16(17-6-2-3-7-18(17)26-14)10-11-25-22(28)19(13-15-5-4-12-30-15)27-23(29)20-8-9-21(24)31-20/h2-9,12-13,26H,10-11H2,1H3,(H,25,28)(H,27,29)/b19-13-
InChIKey BBRRHZVRTIMQCP-UYRXBGFRSA-N
Molecular Weight 482.334 g/mol
SMILES C=1C=CC2=C(NC(=C2CCNC(\C(=C\C=2OC=CC2)NC(C=2OC(Br)=CC2)=O)=O)C)C1