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2-Chloro-N-[3-(2-chloro-phenyl)-2-(4-phenyl-thiazol-2-yl)-allyl]-benzamide

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2-Chloro-N-[3-(2-chloro-phenyl)-2-(4-phenyl-thiazol-2-yl)-allyl]-benzamide
SpectraBase Compound ID BrLnv5Zr5Dp
InChI InChI=1S/C25H18Cl2N2OS/c26-21-12-6-4-10-18(21)14-19(15-28-24(30)20-11-5-7-13-22(20)27)25-29-23(16-31-25)17-8-2-1-3-9-17/h1-14,16H,15H2,(H,28,30)/b19-14+
InChIKey XYPDNBRVCWQSRE-XMHGGMMESA-N
Mol Weight 465.4 g/mol
Molecular Formula C25H18Cl2N2OS
Exact Mass 464.05169 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID q3RmQUsaoQ
Name 2-Chloro-N-[3-(2-chloro-phenyl)-2-(4-phenyl-thiazol-2-yl)-allyl]-benzamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 464.051689781 u
Formula C25H18Cl2N2OS
InChI InChI=1S/C25H18Cl2N2OS/c26-21-12-6-4-10-18(21)14-19(15-28-24(30)20-11-5-7-13-22(20)27)25-29-23(16-31-25)17-8-2-1-3-9-17/h1-14,16H,15H2,(H,28,30)/b19-14+
InChIKey XYPDNBRVCWQSRE-XMHGGMMESA-N
Molecular Weight 465.398 g/mol
SMILES C1(\C=C/(CNC(=O)C2=C(C=CC=C2)Cl)C=2SC=C(N2)C2=CC=CC=C2)=C(C=CC=C1)Cl