AC1LUJ3F
2-[4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: (Z)-2-(4-(5-(4-ethylbenzylidene)-4-oxo-2-thioxothiazolidin-3-yl)butanamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxamide|2-({4-[(5Z)-5-(4-ethylbenzylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]butanoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|2-[4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C25H27N3O3S3 |
|---|---|
| Molecular Weight | 513.12146 g/mol |
| LogP | 4.9083 |
| Topological Polar Surface Area | 92.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 513.12146 |
| Monoisotopic Mass | 513.12146 |
| Heavy Atoms | 34 |
| Complexity | 1168.0588 |
Chemical Identifiers
| CAS Number | 315243-75-5 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=S)S2)CCCC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)N |
Product Overview
AC1LUJ3F (CAS 315243-75-5), with molecular formula C25H27N3O3S3 and molecular weight 513.12146 g/mol. IUPAC: 2-[4-[(5Z)-5-[(4-ethylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]butanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
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