1-(1-benzothiophen-3-ylmethyl)-4-[3,4-bis(fluoranyl)phenyl]sulfonyl-piperazine

Systemtic Name: 1-(1-benzothiophen-3-ylmethyl)-4-[3,4-bis(fluoranyl)phenyl]sulfonyl-piperazine Openeye Name: 1-(benzothiophen-3-ylmethyl)-4-(3,4-difluorophenyl)sulfonyl-piperazine CAS Name: 1-(1-benzothiophen-3-ylmethyl)-4-(3,4-difluorophenyl)sulfonylpiperazine IUPAC Name: 1-(1-benzothiophen-3-ylmethyl)-4-(3,4-difluorophenyl)sulfonylpiperazine Traditional Name: 1-(benzothiophen-3-ylmethyl)-4-(3,4-difluorophenyl)sulfonyl-piperazine Formula: C19H18F2N2O2S2 MolecularWeight: 408.485226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CSC3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)F)F

Isomeric SMILES

C1CN(CCN1CC2=CSC3=CC=CC=C32)S(=O)(=O)C4=CC(=C(C=C4)F)F

InChI

InChI=1S/C19H18F2N2O2S2/c20-17-6-5-15(11-18(17)21)27(24,25)23-9-7-22(8-10-23)12-14-13-26-19-4-2-1-3-16(14)19/h1-6,11,13H,7-10,12H2