N-[(E)-1-(4-bromophenyl)-3-[(1,1-dioxothiolan-3-yl)amino]-3-oxoprop-1-en-2-yl]benzamide
Basic information
- CAS
5143-73-7- Standard SMILES
O=C(NC1CCS(=O)(=O)C1)/C(=C\c1ccc(Br)cc1)NC(=O)c1ccccc1- InChIKey
SNGYIQCBXDLABC-LDADJPATSA-N- Molecular formula
- C20H19BrN2O4S
- Average molar mass
- 463.3 g/mol
- Monoisotopic mass
- 462.02489
Names & identifiers
- Preferred name
- N-[(E)-1-(4-bromophenyl)-3-[(1,1-dioxothiolan-3-yl)amino]-3-oxoprop-1-en-2-yl]benzamide
- IUPAC
- N-[(E)-1-(4-bromophenyl)-3-[(1,1-dioxothiolan-3-yl)amino]-3-oxoprop-1-en-2-yl]benzamide
Names & synonyms
5143-73-7N-[(E)-1-(4-bromophenyl)-3-[(1,1-dioxothiolan-3-yl)amino]-3-oxoprop-1-en-2-yl]benzamideAC1NSP91DTXSID00416703SMSF0003754CB13922BIM-0010800.P001N-(2-(4-bromophenyl)-1-{[(1,1-dioxidotetrahydro-3-thienyl)amino]carbonyl}vinyl)benzamideN-{(1E)-1-(4-Bromophenyl)-3-[(1,1-dioxo-1lambda~6~-thiolan-3-yl)amino]-3-oxoprop-1-en-2-yl}benzamide
Database identifiers
- CAS
5143-73-7- PubChem CID
- 5337629
- DTXSID
DTXSID00416703
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 702
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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