AC1NZVCK
2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]acetonitrile
Also Known As: 2-[[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methylamino]acetonitrile|({(E)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}amino)acetonitrile|(Z)-2-(((4,6-dioxo-2-thioxo-1-(p-tolyl)tetrahydropyrimidin-5(2H)-ylidene)methyl)amino)acetonitrile|2-[[(Z)-[1-(4-methylphenyl)-4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]amino]acetonitrile
CAS: 716331-11-2
| Molecular Formula | C14H12N4O2S |
|---|---|
| Molecular Weight | 300.06808 g/mol |
| LogP | 1.85159 |
| Topological Polar Surface Area | 94.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 300.06808 |
| Monoisotopic Mass | 300.06808 |
| Heavy Atoms | 21 |
| Complexity | 841.2485 |
Chemical Identifiers
| CAS Number | 716331-11-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=S)C=NCC#N)O |
Product Overview
AC1NZVCK (CAS 716331-11-2), with molecular formula C14H12N4O2S and molecular weight 300.06808 g/mol. IUPAC: 2-[[6-hydroxy-1-(4-methylphenyl)-4-oxo-2-sulfanylidenepyrimidin-5-yl]methylideneamino]acetonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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