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N-(5-Propyl-3-[4-(N-methyl-piperazino)-2-butynyl]-1,3,4-thiadiazol-2(3H)-ylidene)-benzamide
SpectraBase Compound ID 93jouqiSstv
InChI InChI=1S/C21H27N5OS/c1-3-9-19-23-26(13-8-7-12-25-16-14-24(2)15-17-25)21(28-19)22-20(27)18-10-5-4-6-11-18/h4-6,10-11H,3,9,12-17H2,1-2H3/b22-21-
InChIKey OIZGPONNEALCKC-DQRAZIAOSA-N
Mol Weight 397.54 g/mol
Molecular Formula C21H27N5OS
Exact Mass 397.193632 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrksmrH71rs
Name N-(5-Propyl-3-[4-(N-methyl-piperazino)-2-butynyl]-1,3,4-thiadiazol-2(3H)-ylidene)-benzamide
CAS Registry Number 103839-53-8
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H27N5OS
InChI InChI=1S/C21H27N5OS/c1-3-9-19-23-26(13-8-7-12-25-16-14-24(2)15-17-25)21(28-19)22-20(27)18-10-5-4-6-11-18/h4-6,10-11H,3,9,12-17H2,1-2H3/b22-21-
InChIKey OIZGPONNEALCKC-DQRAZIAOSA-N
Instrument Name Varian FT-80
Literature Reference S.R. Salman, Z. Muhi-Eldeen, A.H.Yasin, Magn. Res. Chem. 24, 271 (1986).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3