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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(4-methoxyphenyl)piperazine-1-carbothioamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(4-methoxyphenyl)piperazine-1-carbothioamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(4-methoxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(4-methoxyphenyl)piperazine-1-carbothioamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-4-(4-methoxyphenyl)piperazine-1-carbothioamide Formula: C19H21F2N3OS2 MolecularWeight: 409.516346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C19H21F2N3OS2/c1-25-16-6-4-15(5-7-16)23-10-12-24(13-11-23)19(26)22-14-2-8-17(9-3-14)27-18(20)21/h2-9,18H,10-13H2,1H3,(H,22,26)