[4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone

Systemtic Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Openeye Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-[3-(1-piperidylsulfonyl)-2-thienyl]methanone CAS Name: [4-[(2-fluorophenyl)methyl]-1-piperazinyl]-[3-(1-piperidinylsulfonyl)-2-thiophenyl]methanone IUPAC Name: [4-[(2-fluorophenyl)methyl]piperazin-1-yl]-(3-piperidin-1-ylsulfonylthiophen-2-yl)methanone Traditional Name: [4-(2-fluorobenzyl)piperazino]-(3-piperidinosulfonyl-2-thienyl)methanone Formula: C21H26FN3O3S2 MolecularWeight: 451.577843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FN3O3S2/c22-18-7-3-2-6-17(18)16-23-11-13-24(14-12-23)21(26)20-19(8-15-29-20)30(27,28)25-9-4-1-5-10-25/h2-3,6-8,15H,1,4-5,9-14,16H2