N-(4-bromanyl-2-chloranyl-phenyl)-4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazine-1-carbothioamide

Systemtic Name: N-(4-bromanyl-2-chloranyl-phenyl)-4-[(2-chloranyl-4-fluoranyl-phenyl)methyl]piperazine-1-carbothioamide Openeye Name: N-(4-bromo-2-chloro-phenyl)-4-[(2-chloro-4-fluoro-phenyl)methyl]piperazine-1-carbothioamide CAS Name: N-(4-bromo-2-chlorophenyl)-4-[(2-chloro-4-fluorophenyl)methyl]-1-piperazinecarbothioamide IUPAC Name: N-(4-bromo-2-chlorophenyl)-4-[(2-chloro-4-fluorophenyl)methyl]piperazine-1-carbothioamide Traditional Name: N-(4-bromo-2-chloro-phenyl)-4-(2-chloro-4-fluoro-benzyl)piperazine-1-carbothioamide Formula: C18H17BrCl2FN3S MolecularWeight: 477.221083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C(=S)NC3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)F)Cl)C(=S)NC3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C18H17BrCl2FN3S/c19-13-2-4-17(16(21)9-13)23-18(26)25-7-5-24(6-8-25)11-12-1-3-14(22)10-15(12)20/h1-4,9-10H,5-8,11H2,(H,23,26)