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1-Benzoyl-4-[(3-chloro-1-benzothien-2-yl)carbonyl]piperazine

View entire compound with spectra: 2 NMR

1-Benzoyl-4-[(3-chloro-1-benzothien-2-yl)carbonyl]piperazine
SpectraBase Compound ID DThcjInariJ
InChI InChI=1S/C20H17ClN2O2S/c21-17-15-8-4-5-9-16(15)26-18(17)20(25)23-12-10-22(11-13-23)19(24)14-6-2-1-3-7-14/h1-9H,10-13H2
InChIKey IMFMTCYBJHUHEZ-UHFFFAOYSA-N
Mol Weight 384.88 g/mol
Molecular Formula C20H17ClN2O2S
Exact Mass 384.069927 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ITeWojWJgY
Name 1-Benzoyl-4-[(3-chloro-1-benzothien-2-yl)carbonyl]piperazine
Comments Computed using HOSE algorithm
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Exact Mass 384.069926667 u
Formula C20H17ClN2O2S
InChI InChI=1S/C20H17ClN2O2S/c21-17-15-8-4-5-9-16(15)26-18(17)20(25)23-12-10-22(11-13-23)19(24)14-6-2-1-3-7-14/h1-9H,10-13H2
InChIKey IMFMTCYBJHUHEZ-UHFFFAOYSA-N
Molecular Weight 384.881 g/mol
SMILES C=1(SC=2C=CC=CC2C1Cl)C(N1CCN(C(=O)C2=CC=CC=C2)CC1)=O