1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Openeye Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-[4-(1-piperidylsulfonyl)phenyl]propan-1-one CAS Name: 1-[4-[(2-fluorophenyl)methyl]-1-piperazinyl]-3-[4-(1-piperidinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Traditional Name: 1-[4-(2-fluorobenzyl)piperazino]-3-(4-piperidinosulfonylphenyl)propan-1-one Formula: C25H32FN3O3S MolecularWeight: 473.603283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4F

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)N3CCN(CC3)CC4=CC=CC=C4F

InChI

InChI=1S/C25H32FN3O3S/c26-24-7-3-2-6-22(24)20-27-16-18-28(19-17-27)25(30)13-10-21-8-11-23(12-9-21)33(31,32)29-14-4-1-5-15-29/h2-3,6-9,11-12H,1,4-5,10,13-20H2