AC1NE81O
N-[5-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide
Also Known As: Oprea1_476249|Oprea1_798337|F0417-0735|N-(5-((2-((3,5-dimethylphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-1-naphthamide|N-[5-({[(3,5-dimethylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide|N-[5-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide|N-[5-[(3,5-dimethylphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide
| Molecular Formula | C23H20N4O2S2 |
|---|---|
| Molecular Weight | 448.10278 g/mol |
| LogP | 5.29124 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 448.10278 |
| Monoisotopic Mass | 448.10278 |
| Heavy Atoms | 31 |
| Complexity | 1243.9188 |
Chemical Identifiers
| CAS Number | 392296-76-3 |
|---|---|
| SMILES | CC1=CC(=CC(=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=CC4=CC=CC=C43)C |
Product Overview
AC1NE81O (CAS 392296-76-3), with molecular formula C23H20N4O2S2 and molecular weight 448.10278 g/mol. IUPAC: N-[5-[2-(3,5-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]naphthalene-1-carboxamide.
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