AC1MH3TR
2-[(2-nitrobenzoyl)amino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 2-[(2-nitrobenzoyl)amino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|{2-[(2-nitrophenyl)carbonylamino](4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)}-N- benzamide|2-[(2-nitrobenzoyl)amino]-N-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide|2-{[(2-nitrophenyl)carbonyl]amino}-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C22H19N3O4S |
|---|---|
| Molecular Weight | 421.10962 g/mol |
| LogP | 5.0397 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 421.10962 |
| Monoisotopic Mass | 421.10962 |
| Heavy Atoms | 30 |
| Complexity | 1124.6663 |
Chemical Identifiers
| CAS Number | 895950-92-2 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC=CC=C3[N+](=O)[O-])C(=O)NC4=CC=CC=C4 |
Product Overview
AC1MH3TR (CAS 895950-92-2), with molecular formula C22H19N3O4S and molecular weight 421.10962 g/mol. IUPAC: 2-[(2-nitrobenzoyl)amino]-N-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
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