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N-(4-Chlorophenyl)-N-(1-[(2-thiophen-2-yl)ethyl]piperidin-4-yl)-2-methylbenzamide
SpectraBase Compound ID Lk0f6E09c6N
InChI InChI=1S/C25H27ClN2OS/c1-19-5-2-3-7-24(19)25(29)28(21-10-8-20(26)9-11-21)22-12-15-27(16-13-22)17-14-23-6-4-18-30-23/h2-11,18,22H,12-17H2,1H3
InChIKey FULQPZXNLMCWFL-UHFFFAOYSA-N
Mol Weight 439.02 g/mol
Molecular Formula C25H27ClN2OS
Exact Mass 438.153262 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6peQ4M0Nw7L
Name N-(4-Chlorophenyl)-N-{1-[(2-thiophen-2-yl)ethyl]piperidin-4-yl}-2-methylbenzamide
Comments Computed using HOSE algorithm
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Exact Mass 438.153262370 u
Formula C25H27ClN2OS
InChI InChI=1S/C25H27ClN2OS/c1-19-5-2-3-7-24(19)25(29)28(21-10-8-20(26)9-11-21)22-12-15-27(16-13-22)17-14-23-6-4-18-30-23/h2-11,18,22H,12-17H2,1H3
InChIKey FULQPZXNLMCWFL-UHFFFAOYSA-N
Molecular Weight 439.017 g/mol
SMILES C(N(C1CCN(CC1)CCC=1SC=CC1)C1=CC=C(C=C1)Cl)(C=1C(=CC=CC1)C)=O