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3-(4-Chlorophenyl)-2-(1-piperidinyl)-[1]benzothiolo[3,2-d]pyrimidin-4-one
SpectraBase Compound ID 4gYJn0NrRRO
InChI InChI=1S/C21H18ClN3OS/c22-14-8-10-15(11-9-14)25-20(26)19-18(16-6-2-3-7-17(16)27-19)23-21(25)24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-13H2
InChIKey MNRRJDFLLCDZKF-UHFFFAOYSA-N
Mol Weight 395.91 g/mol
Molecular Formula C21H18ClN3OS
Exact Mass 395.085911 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YGkW1x9pHJ
Name 3-(4-Chlorophenyl)-2-(1-piperidinyl)-[1]benzothiolo[3,2-d]pyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18ClN3OS
InChI InChI=1S/C21H18ClN3OS/c22-14-8-10-15(11-9-14)25-20(26)19-18(16-6-2-3-7-17(16)27-19)23-21(25)24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-13H2
InChIKey MNRRJDFLLCDZKF-UHFFFAOYSA-N
Molecular Weight 395.908 g/mol
SMILES c12C(N(c3ccc(cc3)Cl)C(=Nc1c1ccccc1s2)N1CCCCC1)=O
SPLASH splash10-0002-0209000000-4c354fc54d719a9661ca
Source of Spectrum F4-0-4183-6
Synonyms 3-(4-Chlorophenyl)-2-(1-piperidyl)benzothiopheno[3,2-d]pyrimidin-4-one 3-(4-Chlorophenyl)-2-piperidin-1-yl-[1]benzothiolo[3,2-d]pyrimidin-4-one 3-(4-Chlorophenyl)-2-piperidino-benzothiopheno[3,2-d]pyrimidin-4-one
Wiley ID 1621153