Basic information
- CAS
312706-90-4- Standard SMILES
CCOC(=O)c1ccc(Nc2nc(-c3cc4c(ccc5ccccc54)oc3=O)cs2)cc1- InChIKey
SSNYNVBPHMUHHK-UHFFFAOYSA-N- Molecular formula
- C25H18N2O4S
- Average molar mass
- 442.5 g/mol
Names & identifiers
- Preferred name
- Ethyl 4-[[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino]benzoate
- IUPAC
- ethyl 4-[[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino]benzoate
- English name
- ethyl 4-{[4-(3-oxo-3H-benzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino}benzoate
- Molecular formula
- C25H18N2O4S
- Molecular weight
- 442.48642
Names & synonyms
ethyl 4-[[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino]benzoateethyl 4-{[4-(3-oxobenzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino}benzoateETHYL 4-[(4-{3-OXO-3H-BENZO[F]CHROMEN-2-YL}-1,3-THIAZOL-2-YL)AMINO]BENZOATEethyl 4-{[4-(3-oxo-3H-benzo[f]chromen-2-yl)-1,3-thiazol-2-yl]amino}benzoateOprea1_308288Oprea1_474285AKOS000512059EU-0069632ST50008474AG-690/13507141SR-01000414420SR-01000414420-1
Show more names
4-[4-(3-Oxo-3H-benzo[f]chromen-2-yl)-thiazol-2-ylamino]-benzoic acid ethyl ester
Database identifiers
- CAS
312706-90-4
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 735
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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