4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-phenoxyphenyl)piperazine-1-carbothioamide Formula: C30H27F2N3OS MolecularWeight: 515.616686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=S)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C(=S)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C30H27F2N3OS/c31-24-10-6-22(7-11-24)29(23-8-12-25(32)13-9-23)34-18-20-35(21-19-34)30(37)33-26-14-16-28(17-15-26)36-27-4-2-1-3-5-27/h1-17,29H,18-21H2,(H,33,37)