1-(2-fluorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(2-fluorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(2-fluorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium CAS Name: 1-(2-fluorophenyl)-4-[(3-methyl-2-thiophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2-fluorophenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(2-fluorophenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium Formula: C16H20FN2S+ MolecularWeight: 291.406803

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3F

Isomeric SMILES

CC1=C(SC=C1)C[NH+]2CCN(CC2)C3=CC=CC=C3F

InChI

InChI=1S/C16H19FN2S/c1-13-6-11-20-16(13)12-18-7-9-19(10-8-18)15-5-3-2-4-14(15)17/h2-6,11H,7-10,12H2,1H3/p+1