For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

Acetamide, N-(3,4-difluorophenyl)-2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-

View entire compound with spectra: 1 MS (GC)

Acetamide, N-(3,4-difluorophenyl)-2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-
SpectraBase Compound ID 9o3zOpmh1dC
InChI InChI=1S/C23H21F2N5O3S/c1-13-4-6-14(7-5-13)11-30-19-20(28(2)23(33)29(3)21(19)32)27-22(30)34-12-18(31)26-15-8-9-16(24)17(25)10-15/h4-10H,11-12H2,1-3H3,(H,26,31)
InChIKey OUPJSGHIJMOMNR-UHFFFAOYSA-N
Mol Weight 485.51 g/mol
Molecular Formula C23H21F2N5O3S
Exact Mass 485.133317 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2YrniiSAJQP
Name Acetamide, N-(3,4-difluorophenyl)-2-[[2,3,6,7-tetrahydro-1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-dioxo-1H-purin-8-yl]thio]-
Alternate Name(s) N-(3,4-difluorophenyl)-2-[[1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-dioxo-8-purinyl]thio]acetamide N-(3,4-difluorophenyl)-2-[1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-dioxopurin-8-yl]sulfanylacetamide N-(3,4-difluorophenyl)-2-[1,3-dimethyl-2,6-dioxo-7-(p-tolylmethyl)purin-8-yl]sulfanyl-acetamide N-[3,4-bis(fluoranyl)phenyl]-2-[1,3-dimethyl-7-[(4-methylphenyl)methyl]-2,6-bis(oxidanylidene)purin-8-yl]sulfanyl-ethanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21F2N5O3S
InChI InChI=1S/C23H21F2N5O3S/c1-13-4-6-14(7-5-13)11-30-19-20(28(2)23(33)29(3)21(19)32)27-22(30)34-12-18(31)26-15-8-9-16(24)17(25)10-15/h4-10H,11-12H2,1-3H3,(H,26,31)
InChIKey OUPJSGHIJMOMNR-UHFFFAOYSA-N
Molecular Weight 485.510 g/mol
SMILES N(C(CSc1[n](c2C(=O)N(C(=O)N(c2n1)C)C)Cc1ccc(cc1)C)=O)c1ccc(c(c1)F)F
SPLASH splash10-0a4i-2910200000-91ae50d9b8564f0617aa
Source of Spectrum IY-1-4594-6
Wiley ID 1653929