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

Systemtic Name: 4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Openeye Name: 4-[(3-chloro-4-fluoro-phenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide CAS Name: 4-[(3-chloro-4-fluorophenyl)methyl]-N-[(4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: 4-[(3-chloro-4-fluorophenyl)methyl]-N-[(4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: 4-(3-chloro-4-fluoro-benzyl)-N-(4-fluorobenzyl)piperazine-1-carbothioamide Formula: C19H20ClF2N3S MolecularWeight: 395.897006

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=C(C=C2)F)Cl)C(=S)NCC3=CC=C(C=C3)F

Isomeric SMILES

C1CN(CCN1CC2=CC(=C(C=C2)F)Cl)C(=S)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C19H20ClF2N3S/c20-17-11-15(3-6-18(17)22)13-24-7-9-25(10-8-24)19(26)23-12-14-1-4-16(21)5-2-14/h1-6,11H,7-10,12-13H2,(H,23,26)