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

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(4-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-p-phenetyl-piperazine-1-carbothioamide Formula: C26H27F2N3OS MolecularWeight: 467.573886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H27F2N3OS/c1-2-32-24-13-11-23(12-14-24)29-26(33)31-17-15-30(16-18-31)25(19-3-7-21(27)8-4-19)20-5-9-22(28)10-6-20/h3-14,25H,2,15-18H2,1H3,(H,29,33)