N-[4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide

Systemtic Name: N-[4-[4-(2-fluorophenyl)carbonylpiperazin-1-yl]phenyl]-2-phenylsulfanyl-ethanamide Openeye Name: N-[4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-2-phenylsulfanyl-acetamide CAS Name: N-[4-[4-[(2-fluorophenyl)-oxomethyl]-1-piperazinyl]phenyl]-2-(phenylthio)acetamide IUPAC Name: N-[4-[4-(2-fluorobenzoyl)piperazin-1-yl]phenyl]-2-phenylsulfanylacetamide Traditional Name: N-[4-[4-(2-fluorobenzoyl)piperazino]phenyl]-2-(phenylthio)acetamide Formula: C25H24FN3O2S MolecularWeight: 449.540363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)C4=CC=CC=C4F

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)NC(=O)CSC3=CC=CC=C3)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C25H24FN3O2S/c26-23-9-5-4-8-22(23)25(31)29-16-14-28(15-17-29)20-12-10-19(11-13-20)27-24(30)18-32-21-6-2-1-3-7-21/h1-13H,14-18H2,(H,27,30)