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4-(N-Methylsulphonyl-1H-indol-3-yl)-6-(p-chlorophenyl)-pyrimidin-2(1H)-one
SpectraBase Compound ID 6vMdVbcOI3A
InChI InChI=1S/C19H14ClN3O3S/c1-27(25,26)23-11-15(14-4-2-3-5-18(14)23)17-10-16(21-19(24)22-17)12-6-8-13(20)9-7-12/h2-11H,1H3,(H,21,22,24)
InChIKey OWJYRQXZQVUKHQ-UHFFFAOYSA-N
Mol Weight 399.85 g/mol
Molecular Formula C19H14ClN3O3S
Exact Mass 399.04444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F7fqsruVbQ0
Name 4-(N-Methylsulphonyl-1H-indol-3-yl)-6-(p-chlorophenyl)-pyrimidin-2(1H)-one
Appearance Solid
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Formula C19H14ClN3O3S
InChI InChI=1S/C19H14ClN3O3S/c1-27(25,26)23-11-15(14-4-2-3-5-18(14)23)17-10-16(21-19(24)22-17)12-6-8-13(20)9-7-12/h2-11H,1H3,(H,21,22,24)
InChIKey OWJYRQXZQVUKHQ-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2012.04.003
Molecular Weight 399.852 g/mol
SMILES N1C(=CC(=NC1=O)c1c[n](S(C)(=O)=O)c2c1cccc2)c1ccc(cc1)Cl
SPLASH splash10-0006-0900000000-43bbcc0d170586ee26c1
Source of Spectrum AJC-6-68-4b
Wiley ID 1856996