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1H-indole, 3-[[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]carbonyl]-

View entire compound with spectra: 2 NMR

1H-indole, 3-[[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]carbonyl]-
SpectraBase Compound ID Ec3vtn20snI
InChI InChI=1S/C19H18ClN3O3S/c20-14-5-7-15(8-6-14)27(25,26)23-11-9-22(10-12-23)19(24)17-13-21-18-4-2-1-3-16(17)18/h1-8,13,21H,9-12H2
InChIKey KIACDTIZWAKHQJ-UHFFFAOYSA-N
Mol Weight 403.88 g/mol
Molecular Formula C19H18ClN3O3S
Exact Mass 403.07574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5WhV1992kPB
Name 1H-Indole, 3-[[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]carbonyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 403.075740323 u
Formula C19H18ClN3O3S
InChI InChI=1S/C19H18ClN3O3S/c20-14-5-7-15(8-6-14)27(25,26)23-11-9-22(10-12-23)19(24)17-13-21-18-4-2-1-3-16(17)18/h1-8,13,21H,9-12H2
InChIKey KIACDTIZWAKHQJ-UHFFFAOYSA-N
Molecular Weight 403.884 g/mol
SMILES N1C2=C(C(=C1)C(N1CCN(S(C3=CC=C(C=C3)Cl)(=O)=O)CC1)=O)C=CC=C2