1-[(2S)-4-[(2-fluorophenyl)methyl]-2-propan-2-yl-piperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanone

Systemtic Name: 1-[(2S)-4-[(2-fluorophenyl)methyl]-2-propan-2-yl-piperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Openeye Name: 1-[(2S)-4-[(2-fluorophenyl)methyl]-2-isopropyl-piperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanone CAS Name: 1-[(2S)-4-[(2-fluorophenyl)methyl]-2-propan-2-yl-1-piperazinyl]-2-(4-methylsulfonylphenyl)ethanone IUPAC Name: 1-[(2S)-4-[(2-fluorophenyl)methyl]-2-propan-2-ylpiperazin-1-yl]-2-(4-methylsulfonylphenyl)ethanone Traditional Name: 1-[(2S)-4-(2-fluorobenzyl)-2-isopropyl-piperazino]-2-(4-mesylphenyl)ethanone Formula: C23H29FN2O3S MolecularWeight: 432.551363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CN(CCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C)CC3=CC=CC=C3F

Isomeric SMILES

CC(C)[C@H]1CN(CCN1C(=O)CC2=CC=C(C=C2)S(=O)(=O)C)CC3=CC=CC=C3F

InChI

InChI=1S/C23H29FN2O3S/c1-17(2)22-16-25(15-19-6-4-5-7-21(19)24)12-13-26(22)23(27)14-18-8-10-20(11-9-18)30(3,28)29/h4-11,17,22H,12-16H2,1-3H3/t22-/m1/s1