[3-bromanyl-4-[(3-fluorophenyl)methoxy]phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanethione

Systemtic Name: [3-bromanyl-4-[(3-fluorophenyl)methoxy]phenyl]-[4-(phenylmethyl)piperazin-1-yl]methanethione Openeye Name: (4-benzylpiperazin-1-yl)-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]methanethione CAS Name: [3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]-[4-(phenylmethyl)-1-piperazinyl]methanethione IUPAC Name: (4-benzylpiperazin-1-yl)-[3-bromo-4-[(3-fluorophenyl)methoxy]phenyl]methanethione Traditional Name: (4-benzylpiperazino)-[3-bromo-4-(3-fluorobenzyl)oxy-phenyl]methanethione Formula: C25H24BrFN2OS MolecularWeight: 499.438263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=S)C3=CC(=C(C=C3)OCC4=CC(=CC=C4)F)Br

InChI

InChI=1S/C25H24BrFN2OS/c26-23-16-21(9-10-24(23)30-18-20-7-4-8-22(27)15-20)25(31)29-13-11-28(12-14-29)17-19-5-2-1-3-6-19/h1-10,15-16H,11-14,17-18H2