4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-ethylphenyl)piperazine-1-carbothioamide Formula: C26H27F2N3S MolecularWeight: 451.574486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H27F2N3S/c1-2-19-5-3-4-6-24(19)29-26(32)31-17-15-30(16-18-31)25(20-7-11-22(27)12-8-20)21-9-13-23(28)14-10-21/h3-14,25H,2,15-18H2,1H3,(H,29,32)