AC1NN3Y7
4-benzoyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide
Also Known As: Oprea1_635825|4-benzoyl-N-(5-((2-oxo-2-(p-tolylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide|F0417-0157|4-benzoyl-N-[5-({[(4-methylphenyl)carbamoyl]methyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide|4-benzoyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide|4-benzoyl-N-[5-[(4-methylphenyl)carbamoylmethylsulfanyl]-1,3,4-thiadiazol-2-yl]benzamide
| Molecular Formula | C25H20N4O3S2 |
|---|---|
| Molecular Weight | 488.0977 g/mol |
| LogP | 5.06062 |
| Topological Polar Surface Area | 101.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 488.0977 |
| Monoisotopic Mass | 488.0977 |
| Heavy Atoms | 34 |
| Complexity | 1304.2673 |
Chemical Identifiers
| CAS Number | 392291-84-8 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC(=O)CSC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4 |
Product Overview
AC1NN3Y7 (CAS 392291-84-8), with molecular formula C25H20N4O3S2 and molecular weight 488.0977 g/mol. IUPAC: 4-benzoyl-N-[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-thiadiazol-2-yl]benzamide.
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