N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(2-ethoxyphenyl)piperazine-1-carbothioamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-ethoxyphenyl)piperazine-1-carbothioamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(2-ethoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-ethoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-4-o-phenetyl-piperazine-1-carbothioamide Formula: C20H23F2N3OS2 MolecularWeight: 423.542926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=S)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C20H23F2N3OS2/c1-2-26-18-6-4-3-5-17(18)24-11-13-25(14-12-24)20(27)23-15-7-9-16(10-8-15)28-19(21)22/h3-10,19H,2,11-14H2,1H3,(H,23,27)