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

*Links on SpectraBase are not permalinks.
2-[[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide
SpectraBase Compound ID 5fCIEs0ZZAj
InChI InChI=1S/C26H25N3O2S/c1-17-7-3-5-9-22(17)28-24(30)16-32-26-21(15-27)25(18-11-13-19(31-2)14-12-18)20-8-4-6-10-23(20)29-26/h3,5,7,9,11-14H,4,6,8,10,16H2,1-2H3,(H,28,30)
InChIKey PTNKFMXZDWPBIY-UHFFFAOYSA-N
Mol Weight 443.57 g/mol
Molecular Formula C26H25N3O2S
Exact Mass 443.166748 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 4o8rtoBPpQ
Name 2-[[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-methylphenyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25N3O2S
InChI InChI=1S/C26H25N3O2S/c1-17-7-3-5-9-22(17)28-24(30)16-32-26-21(15-27)25(18-11-13-19(31-2)14-12-18)20-8-4-6-10-23(20)29-26/h3,5,7,9,11-14H,4,6,8,10,16H2,1-2H3,(H,28,30)
InChIKey PTNKFMXZDWPBIY-UHFFFAOYSA-N
Molecular Weight 443.565 g/mol
SMILES N(C(CSc1c(c(c2c(CCCC2)n1)-c1ccc(cc1)OC)C#N)=O)c1c(C)cccc1
SPLASH splash10-0a4r-1789000000-f6780cce7535e2610904
Synonyms 2-[[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]sulfanyl]-N-(2-methylphenyl)ethanamide 2-[[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]-N-(2-methylphenyl)acetamide 2-[[3-cyano-4-(4-methoxyphenyl)-5,6,7,8-tetrahydroquinolin-2-yl]thio]-N-(o-tolyl)acetamide
Wiley ID 1453203