4-[bis(4-fluorophenyl)methyl]-N-(2-chloranyl-3-methyl-phenyl)piperazine-1-carbothioamide

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-chloranyl-3-methyl-phenyl)piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-chloro-3-methyl-phenyl)piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-chloro-3-methylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-chloro-3-methylphenyl)piperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-(2-chloro-3-methyl-phenyl)piperazine-1-carbothioamide Formula: C25H24ClF2N3S MolecularWeight: 471.992966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)Cl

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)N2CCN(CC2)C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F)Cl

InChI

InChI=1S/C25H24ClF2N3S/c1-17-3-2-4-22(23(17)26)29-25(32)31-15-13-30(14-16-31)24(18-5-9-20(27)10-6-18)19-7-11-21(28)12-8-19/h2-12,24H,13-16H2,1H3,(H,29,32)