SMSSF-0062885
4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanylidene-1H-pyridine-3-carboxamide
Also Known As: BAS 00635073|4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-thioxo-1,6-dihydropyridine-3-carboxamide|F0182-0052|AE-848/11905235|4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanylidene-1,6-dihydropyridine-3-carboxamide|4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanylidene-1H-pyridine-3-carboxamide|[4-(4-bromophenyl)-5-cyano-2-methyl-6-thioxo(3-hydropyridyl)]-N-benzamide|4-(4-bromophenyl)-6-methyl-5-phenylcarbamoyl-3-cyanopyridine-2(1h)-thione|4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-thioxo-5,6-dihydro-3-pyridinecarboxamide|N-phenyl-4-(p-bromophenyl)-5-cyano-2-methyl-6-thioxo-1,6-dihydronicotinamide
| Molecular Formula | C20H14BrN3OS |
|---|---|
| Molecular Weight | 423.0041 g/mol |
| LogP | 5.60609 |
| Topological Polar Surface Area | 68.68 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.0041 |
| Monoisotopic Mass | 423.0041 |
| Heavy Atoms | 26 |
| Complexity | 1067.1958 |
Chemical Identifiers
| CAS Number | 201280-69-5 |
|---|---|
| SMILES | CC1=C(C(=C(C(=S)N1)C#N)C2=CC=C(C=C2)Br)C(=O)NC3=CC=CC=C3 |
Product Overview
SMSSF-0062885 (CAS 201280-69-5), with molecular formula C20H14BrN3OS and molecular weight 423.0041 g/mol. IUPAC: 4-(4-bromophenyl)-5-cyano-2-methyl-N-phenyl-6-sulfanylidene-1H-pyridine-3-carboxamide.