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

*Links on SpectraBase are not permalinks.
2-Amino-4-(4-methoxyphenyl)-6-[(2-oxocyclohexyl)thio]pyridine-3,5-dicarbonitrile
SpectraBase Compound ID DYmKSf0iNOa
InChI InChI=1S/C20H18N4O2S/c1-26-13-8-6-12(7-9-13)18-14(10-21)19(23)24-20(15(18)11-22)27-17-5-3-2-4-16(17)25/h6-9,17H,2-5H2,1H3,(H2,23,24)
InChIKey RAKUPDHSHSKIJP-UHFFFAOYSA-N
Mol Weight 378.45 g/mol
Molecular Formula C20H18N4O2S
Exact Mass 378.115047 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 AlSHfXLwkJx
Name 2-Amino-4-(4-methoxyphenyl)-6-[(2-oxocyclohexyl)thio]pyridine-3,5-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18N4O2S
InChI InChI=1S/C20H18N4O2S/c1-26-13-8-6-12(7-9-13)18-14(10-21)19(23)24-20(15(18)11-22)27-17-5-3-2-4-16(17)25/h6-9,17H,2-5H2,1H3,(H2,23,24)
InChIKey RAKUPDHSHSKIJP-UHFFFAOYSA-N
Molecular Weight 378.450 g/mol
SMILES Nc1c(C#N)c(c(c(n1)SC1C(=O)CCCC1)C#N)-c1ccc(cc1)OC
SPLASH splash10-0ufr-6598000000-37ba39dd65104326da74
Synonyms 2-Amino-6-[(2-ketocyclohexyl)thio]-4-(4-methoxyphenyl)dinicotinonitrile 2-Azanyl-4-(4-methoxyphenyl)-6-(2-oxidanylidenecyclohexyl)sulfanyl-pyridine-3,5-dicarbonitrile 2-Amino-4-(4-methoxyphenyl)-6-(2-oxocyclohexyl)sulfanylpyridine-3,5-dicarbonitrile
Wiley ID 1452790