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4-(4-chlorophenyl)-N-[(E)-1-(2-thienyl)ethylidene]-1-piperazinamine

View entire compound with spectra: 2 NMR

4-(4-chlorophenyl)-N-[(E)-1-(2-thienyl)ethylidene]-1-piperazinamine
SpectraBase Compound ID 6XYPQXcpZEB
InChI InChI=1S/C16H18ClN3S/c1-13(16-3-2-12-21-16)18-20-10-8-19(9-11-20)15-6-4-14(17)5-7-15/h2-7,12H,8-11H2,1H3/b18-13+
InChIKey UFOZNJRHVQOLAD-QGOAFFKASA-N
Mol Weight 319.85 g/mol
Molecular Formula C16H18ClN3S
Exact Mass 319.090996 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID TYU85vHHCQ
Name 4-(4-Chlorophenyl)-N-[(E)-1-(2-thienyl)ethylidene]-1-piperazinamine
Comments Computed using HOSE algorithm
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Exact Mass 319.090996466 u
Formula C16H18ClN3S
InChI InChI=1S/C16H18ClN3S/c1-13(16-3-2-12-21-16)18-20-10-8-19(9-11-20)15-6-4-14(17)5-7-15/h2-7,12H,8-11H2,1H3/b18-13+
InChIKey UFOZNJRHVQOLAD-QGOAFFKASA-N
Molecular Weight 319.854 g/mol
SMILES C\C(=N/N1CCN(CC1)C=1C=CC(=CC1)Cl)C=1SC=CC1