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N-(diphenylacetyl)-N'-[2-(1-pyrrolidinyl)phenyl]thiourea

View entire compound with spectra: 2 NMR

N-(diphenylacetyl)-N'-[2-(1-pyrrolidinyl)phenyl]thiourea
SpectraBase Compound ID BwSstPPrDgF
InChI InChI=1S/C25H25N3OS/c29-24(23(19-11-3-1-4-12-19)20-13-5-2-6-14-20)27-25(30)26-21-15-7-8-16-22(21)28-17-9-10-18-28/h1-8,11-16,23H,9-10,17-18H2,(H2,26,27,29,30)
InChIKey YBKUPDJTMGUSMK-UHFFFAOYSA-N
Mol Weight 415.56 g/mol
Molecular Formula C25H25N3OS
Exact Mass 415.171834 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DY3ruTcphQ6
Name N-(Diphenylacetyl)-N'-[2-(1-pyrrolidinyl)phenyl]thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.171833610 u
Formula C25H25N3OS
InChI InChI=1S/C25H25N3OS/c29-24(23(19-11-3-1-4-12-19)20-13-5-2-6-14-20)27-25(30)26-21-15-7-8-16-22(21)28-17-9-10-18-28/h1-8,11-16,23H,9-10,17-18H2,(H2,26,27,29,30)
InChIKey YBKUPDJTMGUSMK-UHFFFAOYSA-N
Molecular Weight 415.555 g/mol
SMILES N(C(C(C1=CC=CC=C1)C=1C=CC=CC1)=O)C(NC1=C(N2CCCC2)C=CC=C1)=S