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4-Amino-5-(4-chlorobenzoyl)-2-(4-benzyl-1-piperazinyl)-3-thiophenecarbonitrile
SpectraBase Compound ID 2DgW51t1xE3
InChI InChI=1S/C23H21ClN4OS/c24-18-8-6-17(7-9-18)21(29)22-20(26)19(14-25)23(30-22)28-12-10-27(11-13-28)15-16-4-2-1-3-5-16/h1-9H,10-13,15,26H2
InChIKey AFTDAUDORGETAR-UHFFFAOYSA-N
Mol Weight 436.96 g/mol
Molecular Formula C23H21ClN4OS
Exact Mass 436.11246 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JkzeKz9eedm
Name 4-Amino-5-(4-chlorobenzoyl)-2-(4-benzyl-1-piperazinyl)-3-thiophenecarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21ClN4OS
InChI InChI=1S/C23H21ClN4OS/c24-18-8-6-17(7-9-18)21(29)22-20(26)19(14-25)23(30-22)28-12-10-27(11-13-28)15-16-4-2-1-3-5-16/h1-9H,10-13,15,26H2
InChIKey AFTDAUDORGETAR-UHFFFAOYSA-N
Molecular Weight 436.961 g/mol
SMILES Nc1c(C#N)c(sc1C(c1ccc(cc1)Cl)=O)N1CCN(CC1)Cc1ccccc1
SPLASH splash10-0a4i-1509000000-a7a219ba24576a5e5950
Source of Spectrum F-65-10457-17
Wiley ID 1678578