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4-Amino-N-[7-(4-chloro-benzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]-benzenesulfonamide
SpectraBase Compound ID IhdPHh9sVdl
InChI InChI=1S/C20H19ClN6O4S/c1-25-17-16(18(28)26(2)20(25)29)27(11-12-3-5-13(21)6-4-12)19(23-17)24-32(30,31)15-9-7-14(22)8-10-15/h3-10H,11,22H2,1-2H3,(H,23,24)
InChIKey XREMROMPSDRUFB-UHFFFAOYSA-N
Mol Weight 474.92 g/mol
Molecular Formula C20H19ClN6O4S
Exact Mass 474.087702 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mfRvgfOudS
Name 4-Amino-N-[7-(4-chloro-benzyl)-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl]-benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19ClN6O4S
InChI InChI=1S/C20H19ClN6O4S/c1-25-17-16(18(28)26(2)20(25)29)27(11-12-3-5-13(21)6-4-12)19(23-17)24-32(30,31)15-9-7-14(22)8-10-15/h3-10H,11,22H2,1-2H3,(H,23,24)
InChIKey XREMROMPSDRUFB-UHFFFAOYSA-N
Molecular Weight 474.923 g/mol
SMILES N(S(c1ccc(cc1)N)(=O)=O)c1nc2c([n]1Cc1ccc(cc1)Cl)C(=O)N(C(N2C)=O)C
SPLASH splash10-004i-2901000000-cedc520d10f8c4bfd605
Wiley ID 1454743