6-chloranyl-N-[(4-fluorophenyl)methyl]-9,10,10-tris(oxidanylidene)thioxanthene-1-carboxamide

Systemtic Name: 6-chloranyl-N-[(4-fluorophenyl)methyl]-9,10,10-tris(oxidanylidene)thioxanthene-1-carboxamide Openeye Name: 6-chloro-N-[(4-fluorophenyl)methyl]-9,10,10-trioxo-thioxanthene-1-carboxamide CAS Name: 6-chloro-N-[(4-fluorophenyl)methyl]-9,10,10-trioxo-1-thioxanthenecarboxamide IUPAC Name: 6-chloro-N-[(4-fluorophenyl)methyl]-9,10,10-trioxothioxanthene-1-carboxamide Traditional Name: 6-chloro-N-(4-fluorobenzyl)-9,10,10-triketo-thioxanthene-1-carboxamide Formula: C21H13ClFNO4S MolecularWeight: 429.848623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C2C(=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)Cl)C(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1=CC(=C2C(=C1)S(=O)(=O)C3=C(C2=O)C=CC(=C3)Cl)C(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C21H13ClFNO4S/c22-13-6-9-15-18(10-13)29(27,28)17-3-1-2-16(19(17)20(15)25)21(26)24-11-12-4-7-14(23)8-5-12/h1-10H,11H2,(H,24,26)