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N-(3-chlorophenyl)-N'-[4-(1-pyrrolidinylsulfonyl)phenyl]urea

View entire compound with spectra: 2 NMR

N-(3-chlorophenyl)-N'-[4-(1-pyrrolidinylsulfonyl)phenyl]urea
SpectraBase Compound ID IXLkbrjtwZt
InChI InChI=1S/C17H18ClN3O3S/c18-13-4-3-5-15(12-13)20-17(22)19-14-6-8-16(9-7-14)25(23,24)21-10-1-2-11-21/h3-9,12H,1-2,10-11H2,(H2,19,20,22)
InChIKey ZPEZQOXWVYLPJE-UHFFFAOYSA-N
Mol Weight 379.86 g/mol
Molecular Formula C17H18ClN3O3S
Exact Mass 379.07574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID tUcuEqX2eX
Name N-(3-Chlorophenyl)-N'-[4-(1-pyrrolidinylsulfonyl)phenyl]urea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.075740323 u
Formula C17H18ClN3O3S
InChI InChI=1S/C17H18ClN3O3S/c18-13-4-3-5-15(12-13)20-17(22)19-14-6-8-16(9-7-14)25(23,24)21-10-1-2-11-21/h3-9,12H,1-2,10-11H2,(H2,19,20,22)
InChIKey ZPEZQOXWVYLPJE-UHFFFAOYSA-N
Molecular Weight 379.862 g/mol
SMILES N(C(=O)NC=1C=CC(S(N2CCCC2)(=O)=O)=CC1)C=1C=C(Cl)C=CC1