6-fluoranyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-4H-1,3-benzodioxine-8-carboxamide

Systemtic Name: 6-fluoranyl-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-4H-1,3-benzodioxine-8-carboxamide Openeye Name: 6-fluoro-N-[(2-phenylthiazol-4-yl)methyl]-4H-1,3-benzodioxine-8-carboxamide CAS Name: 6-fluoro-N-[(2-phenyl-4-thiazolyl)methyl]-4H-1,3-benzodioxin-8-carboxamide IUPAC Name: 6-fluoro-N-[(2-phenyl-1,3-thiazol-4-yl)methyl]-4H-1,3-benzodioxine-8-carboxamide Traditional Name: 6-fluoro-N-[(2-phenylthiazol-4-yl)methyl]-4H-1,3-benzodioxin-8-carboxamide Formula: C19H15FN2O3S MolecularWeight: 370.397403

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C(=CC(=C2)F)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4)OCO1

Isomeric SMILES

C1C2=C(C(=CC(=C2)F)C(=O)NCC3=CSC(=N3)C4=CC=CC=C4)OCO1

InChI

InChI=1S/C19H15FN2O3S/c20-14-6-13-9-24-11-25-17(13)16(7-14)18(23)21-8-15-10-26-19(22-15)12-4-2-1-3-5-12/h1-7,10H,8-9,11H2,(H,21,23)