8-(4-Benzylphenyl)-9-sulfanylidene-1,6,8-triazabicyclo(4.3.0)nonan-7-one
2-(4-benzylphenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one
Also Known As: 8-(4-Benzylphenyl)-9-sulfanylidene-1,6,8-triazabicyclo(4.3.0)nonan-7-one|2-(4-benzylphenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one|8-(4-benzylphenyl)-9-sulfanylidene-1,6,8-triazabicyclo[4.3.0]nonan-7-one|2-(4-Benzylphenyl)-3-sulfanylidenehexahydro-1H-[1,2,4]triazolo[1,2-a]pyridazin-1-one|2-(4-benzylphenyl)-3-thioxohexahydro-1h-[1,2,4]triazolo[1,2-a]pyridazin-1-one
| Molecular Formula | C19H19N3OS |
|---|---|
| Molecular Weight | 337.12488 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.12488 |
| Monoisotopic Mass | 337.12488 |
| Heavy Atoms | 24 |
| Complexity | 483.0 |
Chemical Identifiers
| CAS Number | 76995-66-9 |
|---|---|
| SMILES | C1CCN2C(=S)N(C(=O)N2C1)C3=CC=C(C=C3)CC4=CC=CC=C4 |
| InChIKey | ZBYPTVOGRRMNBX-UHFFFAOYSA-N |
Product Overview
8-(4-Benzylphenyl)-9-sulfanylidene-1,6,8-triazabicyclo(4.3.0)nonan-7-one (CAS 76995-66-9), with molecular formula C19H19N3OS and molecular weight 337.12488 g/mol. IUPAC: 2-(4-benzylphenyl)-3-sulfanylidene-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,2-a]pyridazin-1-one.
8-(4-Benzylphenyl)-9-sulfanylidene-1,6,8-triazabicyclo(4.3.0)nonan-7-one is a custom synthesis product. We offer services from milligram to kilogram scale.
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