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2-[4-(p-CHLOROPHENYL)-1-PIPERAZINYL]-4-{[(DIMETHYLAMINO)METHYLENE]AMINO}-5-THIAZOLECARBOXYLIC ACID, METHYL ESTER
SpectraBase Compound ID JgYCluBAXxK
InChI InChI=1S/C18H22ClN5O2S/c1-22(2)12-20-16-15(17(25)26-3)27-18(21-16)24-10-8-23(9-11-24)14-6-4-13(19)5-7-14/h4-7,12H,8-11H2,1-3H3/b20-12+
InChIKey RDNOQIDGTUYQSY-UDWIEESQSA-N
Mol Weight 407.92 g/mol
Molecular Formula C18H22ClN5O2S
Exact Mass 407.118274 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9cZlUyeIJg6
Name 2-[4-(p-CHLOROPHENYL)-1-PIPERAZINYL]-4-{[(DIMETHYLAMINO)METHYLENE]AMINO}-5-THIAZOLECARBOXYLIC ACID, METHYL ESTER
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22ClN5O2S
InChI InChI=1S/C18H22ClN5O2S/c1-22(2)12-20-16-15(17(25)26-3)27-18(21-16)24-10-8-23(9-11-24)14-6-4-13(19)5-7-14/h4-7,12H,8-11H2,1-3H3/b20-12+
InChIKey RDNOQIDGTUYQSY-UDWIEESQSA-N
Instrument Name BRUKER AC-300
Melting Point 190-192C
Molecular Weight 407.92
Solvent CDCl3; Reference=TMS; Temperature 297K