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

Systemtic Name: 4-[bis(4-fluorophenyl)methyl]-N-propyl-piperazine-1-carbothioamide Openeye Name: 4-[bis(4-fluorophenyl)methyl]-N-propyl-piperazine-1-carbothioamide CAS Name: 4-[bis(4-fluorophenyl)methyl]-N-propyl-1-piperazinecarbothioamide IUPAC Name: 4-[bis(4-fluorophenyl)methyl]-N-propylpiperazine-1-carbothioamide Traditional Name: 4-[bis(4-fluorophenyl)methyl]-N-propyl-piperazine-1-carbothioamide Formula: C21H25F2N3S MolecularWeight: 389.505106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

Isomeric SMILES

CCCNC(=S)N1CCN(CC1)C(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F

InChI

InChI=1S/C21H25F2N3S/c1-2-11-24-21(27)26-14-12-25(13-15-26)20(16-3-7-18(22)8-4-16)17-5-9-19(23)10-6-17/h3-10,20H,2,11-15H2,1H3,(H,24,27)