AC1N3EDH
6-tert-butyl-2-[(2-phenylsulfanylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: 6-tert-butyl-2-[(2-phenylsulfanylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|6-tert-butyl-2-{[(phenylsulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide|2-[(2-phenylsulfanylacetyl)amino]-6-tert-butyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide|6-(tert-butyl)-2-(2-phenylthioacetylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene -3-carboxamide|6-(TERT-BUTYL)-2-{[2-(PHENYLSULFANYL)ACETYL]AMINO}-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXAMIDE
| Molecular Formula | C21H26N2O2S2 |
|---|---|
| Molecular Weight | 402.1436 g/mol |
| LogP | 4.7288 |
| Topological Polar Surface Area | 72.19 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 402.1436 |
| Monoisotopic Mass | 402.1436 |
| Heavy Atoms | 27 |
| Complexity | 837.85675 |
Chemical Identifiers
| CAS Number | 445015-68-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)CSC3=CC=CC=C3 |
Product Overview
AC1N3EDH (CAS 445015-68-9), with molecular formula C21H26N2O2S2 and molecular weight 402.1436 g/mol. IUPAC: 6-tert-butyl-2-[(2-phenylsulfanylacetyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.