AC1MGU9T
methyl 6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: methyl 6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate|methyl 6-((2-(benzylamino)-2-oxoethyl)thio)-5-cyano-2-oxo-4-(p-tolyl)-1,2,3,4-tetrahydropyridine-3-carboxylate|METHYL 6-{[(BENZYLCARBAMOYL)METHYL]SULFANYL}-5-CYANO-4-(4-METHYLPHENYL)-2-OXO-1,2,3,4-TETRAHYDROPYRIDINE-3-CARBOXYLATE|methyl 6-{[2-(benzylamino)-2-oxoethyl]sulfanyl}-5-cyano-4-(4-methylphenyl)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate
| Molecular Formula | C24H23N3O4S |
|---|---|
| Molecular Weight | 449.14093 g/mol |
| LogP | 2.7824 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 449.14093 |
| Monoisotopic Mass | 449.14093 |
| Heavy Atoms | 32 |
| Complexity | 1074.6732 |
Chemical Identifiers
| CAS Number | 488709-87-1 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NCC3=CC=CC=C3)C(=O)OC |
Product Overview
AC1MGU9T (CAS 488709-87-1), with molecular formula C24H23N3O4S and molecular weight 449.14093 g/mol. IUPAC: methyl 6-[2-(benzylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-3-carboxylate.
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