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1H-Pyrrole-2,5-dione, 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-(3-chlorophenyl)dihydro-
SpectraBase Compound ID 6NCP4AOMKvk
InChI InChI=1S/C21H19ClN4O2S/c22-14-4-3-5-15(12-14)26-19(27)13-17(20(26)28)24-8-10-25(11-9-24)21-23-16-6-1-2-7-18(16)29-21/h1-7,12,17H,8-11,13H2
InChIKey AHLSSTFXVZGVKN-UHFFFAOYSA-N
Mol Weight 426.92 g/mol
Molecular Formula C21H19ClN4O2S
Exact Mass 426.091725 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JWqODQ2woc2
Name 1H-Pyrrole-2,5-dione, 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-(3-chlorophenyl)dihydro-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19ClN4O2S
InChI InChI=1S/C21H19ClN4O2S/c22-14-4-3-5-15(12-14)26-19(27)13-17(20(26)28)24-8-10-25(11-9-24)21-23-16-6-1-2-7-18(16)29-21/h1-7,12,17H,8-11,13H2
InChIKey AHLSSTFXVZGVKN-UHFFFAOYSA-N
Molecular Weight 426.922 g/mol
SMILES c1cc2nc(N3CCN(C4C(N(C(C4)=O)c4cc(Cl)ccc4)=O)CC3)sc2cc1
SPLASH splash10-03di-1920000000-fe0486f7eb09be493323
Source of Spectrum IY-1-4668-2
Synonyms 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]-1-(3-chlorophenyl)pyrrolidine-2,5-dione
Wiley ID 1654665