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

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-methylphenyl)piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(o-tolyl)piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-(o-tolyl)piperazine-1-carbothioamide Formula: C25H25F2N3S MolecularWeight: 437.547906

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H25F2N3S/c1-18-4-2-3-5-23(18)28-25(31)30-16-14-29(15-17-30)24(19-6-10-21(26)11-7-19)20-8-12-22(27)13-9-20/h2-13,24H,14-17H2,1H3,(H,28,31)