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

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(2-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(2-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(2-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-4-(2-hydroxyphenyl)piperazine-1-carbothioamide Formula: C18H19F2N3OS2 MolecularWeight: 395.489766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2O)C(=S)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2O)C(=S)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C18H19F2N3OS2/c19-17(20)26-14-7-5-13(6-8-14)21-18(25)23-11-9-22(10-12-23)15-3-1-2-4-16(15)24/h1-8,17,24H,9-12H2,(H,21,25)