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6-AMINO-5-[2'-(4-CHLOROPHENYLSULFONYL)-1'-(4-CHLOROPHENYL)-ETHYL]-2-MERCAPTOPYRIMIDINE-4-ONE

View entire compound with spectra: 1 NMR

6-AMINO-5-[2'-(4-CHLOROPHENYLSULFONYL)-1'-(4-CHLOROPHENYL)-ETHYL]-2-MERCAPTOPYRIMIDINE-4-ONE
SpectraBase Compound ID 7vQ9NBTviV6
InChI InChI=1S/C19H17Cl2N3O3S2/c20-13-5-1-11(2-6-13)9-29(26,27)10-15(12-3-7-14(21)8-4-12)16-17(22)23-19(28)24-18(16)25/h1-8,15-16H,9-10H2,(H3,22,23,24,25,28)
InChIKey QBVUXPHNABZHJK-UHFFFAOYSA-N
Mol Weight 470.39 g/mol
Molecular Formula C19H17Cl2N3O3S2
Exact Mass 469.008839 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BPIafLHhKm5
Name 6-AMINO-5-[2'-(4-CHLOROPHENYLSULFONYL)-1'-(4-CHLOROPHENYL)-ETHYL]-2-MERCAPTOPYRIMIDINE-4-ONE
Compound Number 18B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17Cl2N3O3S2
InChI InChI=1S/C19H17Cl2N3O3S2/c20-13-5-1-11(2-6-13)9-29(26,27)10-15(12-3-7-14(21)8-4-12)16-17(22)23-19(28)24-18(16)25/h1-8,15-16H,9-10H2,(H3,22,23,24,25,28)
InChIKey QBVUXPHNABZHJK-UHFFFAOYSA-N
Literature Reference Author V.PADMAVATHI,D.R.C.V.SUBBAIAH,K.MAHESH,T.R.LAKSHMI
Literature Reference Citation CHEM.PHARM.BULL.,55,1704(2007)
Literature Reference DOI 10.1248/cpb.55.1704
Molecular Weight 470.388 g/mol
Sample ID 56038
Solvent CDCl3:DMSO-D6