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3-(3-Chlorophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(furan-2-ylmethyl)thiourea

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3-(3-Chlorophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(furan-2-ylmethyl)thiourea
SpectraBase Compound ID 6I0SDene9md
InChI InChI=1S/C21H22ClN3OS/c1-24(2)19-10-8-16(9-11-19)14-25(15-20-7-4-12-26-20)21(27)23-18-6-3-5-17(22)13-18/h3-13H,14-15H2,1-2H3,(H,23,27)
InChIKey FNSOERYIAJKAHJ-UHFFFAOYSA-N
Mol Weight 399.94 g/mol
Molecular Formula C21H22ClN3OS
Exact Mass 399.117211 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5X03PWQc3Od
Name 3-(3-Chlorophenyl)-1-[(4-dimethylaminophenyl)methyl]-1-(furan-2-ylmethyl)thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 399.117211213 u
Formula C21H22ClN3OS
InChI InChI=1S/C21H22ClN3OS/c1-24(2)19-10-8-16(9-11-19)14-25(15-20-7-4-12-26-20)21(27)23-18-6-3-5-17(22)13-18/h3-13H,14-15H2,1-2H3,(H,23,27)
InChIKey FNSOERYIAJKAHJ-UHFFFAOYSA-N
Molecular Weight 399.940 g/mol
SMILES C(N(CC=1OC=CC1)CC1=CC=C(C=C1)N(C)C)(NC=1C=C(Cl)C=CC1)=S