N-[(4-fluorophenyl)methyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-9,10,10-tris(oxidanylidene)thioxanthene-3-carboxamide Openeye Name: N-[(4-fluorophenyl)methyl]-9,10,10-trioxo-thioxanthene-3-carboxamide CAS Name: N-[(4-fluorophenyl)methyl]-9,10,10-trioxo-3-thioxanthenecarboxamide IUPAC Name: N-[(4-fluorophenyl)methyl]-9,10,10-trioxothioxanthene-3-carboxamide Traditional Name: N-(4-fluorobenzyl)-9,10,10-triketo-thioxanthene-3-carboxamide Formula: C21H14FNO4S MolecularWeight: 395.403563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2(=O)=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H14FNO4S/c22-15-8-5-13(6-9-15)12-23-21(25)14-7-10-17-19(11-14)28(26,27)18-4-2-1-3-16(18)20(17)24/h1-11H,12H2,(H,23,25)