AC1N8XZ9
N-[5-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethylbenzamide
Also Known As: Oprea1_547784|F0417-0459|N-[5-({[(2,3-dimethylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]-3,4-dimethylbenzamide|N-(5-((2-((2,3-dimethylphenyl)amino)-2-oxoethyl)thio)-1,3,4-thiadiazol-2-yl)-3,4-dimethylbenzamide|N-[5-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethylbenzamide|N-[5-[(2,3-dimethylphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]-3,4-dimethyl-benzamide
| Molecular Formula | C21H22N4O2S2 |
|---|---|
| Molecular Weight | 426.1184 g/mol |
| LogP | 4.75488 |
| Topological Polar Surface Area | 83.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 426.1184 |
| Monoisotopic Mass | 426.1184 |
| Heavy Atoms | 29 |
| Complexity | 1062.5847 |
Chemical Identifiers
| CAS Number | 392294-55-2 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC(=C(C=C3)C)C)C |
Product Overview
AC1N8XZ9 (CAS 392294-55-2), with molecular formula C21H22N4O2S2 and molecular weight 426.1184 g/mol. IUPAC: N-[5-[2-(2,3-dimethylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]-3,4-dimethylbenzamide.
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