N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-oxidanylidene-thioxanthene-4-carboxamide

Systemtic Name: N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-oxidanylidene-thioxanthene-4-carboxamide Openeye Name: N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-oxo-thioxanthene-4-carboxamide CAS Name: N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-oxo-4-thioxanthenecarboxamide IUPAC Name: N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-oxothioxanthene-4-carboxamide Traditional Name: N-[4-[4-[2-(4-fluorophenyl)ethylamino]butyl]phenyl]-9-keto-thioxanthene-4-carboxamide Formula: C32H29FN2O2S MolecularWeight: 524.648263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(S2)C(=CC=C3)C(=O)NC4=CC=C(C=C4)CCCCNCCC5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2)C(=CC=C3)C(=O)NC4=CC=C(C=C4)CCCCNCCC5=CC=C(C=C5)F

InChI

InChI=1S/C32H29FN2O2S/c33-24-15-11-23(12-16-24)19-21-34-20-4-3-6-22-13-17-25(18-14-22)35-32(37)28-9-5-8-27-30(36)26-7-1-2-10-29(26)38-31(27)28/h1-2,5,7-18,34H,3-4,6,19-21H2,(H,35,37)