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1-Butyl-3-(2-oxo-1-phenylindolin-3-yl)thiourea

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Butyl-3-(2-oxo-1-phenylindolin-3-yl)thiourea
SpectraBase Compound ID 7l6RqtcvMdJ
InChI InChI=1S/C19H21N3OS/c1-2-3-13-20-19(24)21-17-15-11-7-8-12-16(15)22(18(17)23)14-9-5-4-6-10-14/h4-12,17H,2-3,13H2,1H3,(H2,20,21,24)
InChIKey SWHUVUWFJIKWJH-UHFFFAOYSA-N
Mol Weight 339.46 g/mol
Molecular Formula C19H21N3OS
Exact Mass 339.140533 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GDCrgzNxDQw
Name 1-Butyl-3-(2-oxo-1-phenylindolin-3-yl)thiourea
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 339.140533481 u
Formula C19H21N3OS
InChI InChI=1S/C19H21N3OS/c1-2-3-13-20-19(24)21-17-15-11-7-8-12-16(15)22(18(17)23)14-9-5-4-6-10-14/h4-12,17H,2-3,13H2,1H3,(H2,20,21,24)
InChIKey SWHUVUWFJIKWJH-UHFFFAOYSA-N
Molecular Weight 339.457 g/mol
SMILES C1(N(C=2C=CC=CC2C1NC(=S)NCCCC)C1=CC=CC=C1)=O