AC1LF1XF
2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile
Also Known As: CBMicro_013794|BAS 01279654|BIM-0014024.P001|SR-01000395619-1|2-amino-4-ethyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}pyridine-3,5-dicarbonitrile|2-amino-4-ethyl-6-{[2-(4-methylphenyl)-2-oxoethyl]thio}-3,5-pyridinedicarbonitrile|2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile|2-amino-4-ethyl-6-((2-oxo-2-(p-tolyl)ethyl)thio)pyridine-3,5-dicarbonitrile|2-Amino-4-ethyl-6-(2-oxo-2-p-tolyl-ethylsulfanyl)-pyridine-3,5-dicarbonitrile|6-amino-4-ethyl-2-[2-(4-methylphenyl)-2-oxoethylthio]pyridine-3,5-dicarbonitri le
| Molecular Formula | C18H16N4OS |
|---|---|
| Molecular Weight | 336.1045 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.1045 |
| Monoisotopic Mass | 336.1045 |
| Heavy Atoms | 24 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 184530-23-2 |
|---|---|
| SMILES | CCC1=C(C(=NC(=C1C#N)SCC(=O)C2=CC=C(C=C2)C)N)C#N |
| InChIKey | KMHAILNWUHLBEA-UHFFFAOYSA-N |
Product Overview
AC1LF1XF (CAS 184530-23-2), with molecular formula C18H16N4OS and molecular weight 336.1045 g/mol. IUPAC: 2-amino-4-ethyl-6-[2-(4-methylphenyl)-2-oxoethyl]sulfanylpyridine-3,5-dicarbonitrile.