AC1M0OQ4
ethyl 2-[(4-nitrophenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: Oprea1_170115|Oprea1_483737|CBDivE_003892|ETHYL 2-(4-NITROBENZENESULFONAMIDO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE|ethyl 2-{[(4-nitrophenyl)sulfonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|SR-01000196399-1|Ethyl 2-((4-nitrophenyl)sulfonamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-[(4-nitrophenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|ethyl 2-[(4-nitrophenyl)sulfonylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate
| Molecular Formula | C17H18N2O6S2 |
|---|---|
| Molecular Weight | 410.06064 g/mol |
| LogP | 3.5126 |
| Topological Polar Surface Area | 115.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 410.06064 |
| Monoisotopic Mass | 410.06064 |
| Heavy Atoms | 27 |
| Complexity | 979.5977 |
Chemical Identifiers
| CAS Number | 63183-27-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCCC2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
AC1M0OQ4 (CAS 63183-27-7), with molecular formula C17H18N2O6S2 and molecular weight 410.06064 g/mol. IUPAC: ethyl 2-[(4-nitrophenyl)sulfonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
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