N-(3-fluorophenyl)-2-[4-(2-pyridin-4-ylsulfanylethanoyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(3-fluorophenyl)-2-[4-(2-pyridin-4-ylsulfanylethanoyl)piperazin-1-yl]ethanamide Openeye Name: N-(3-fluorophenyl)-2-[4-[2-(4-pyridylsulfanyl)acetyl]piperazin-1-yl]acetamide CAS Name: N-(3-fluorophenyl)-2-[4-[1-oxo-2-(pyridin-4-ylthio)ethyl]-1-piperazinyl]acetamide IUPAC Name: N-(3-fluorophenyl)-2-[4-(2-pyridin-4-ylsulfanylacetyl)piperazin-1-yl]acetamide Traditional Name: N-(3-fluorophenyl)-2-[4-[2-(4-pyridylthio)acetyl]piperazino]acetamide Formula: C19H21FN4O2S MolecularWeight: 388.459043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC(=CC=C2)F)C(=O)CSC3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC(=CC=C2)F)C(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C19H21FN4O2S/c20-15-2-1-3-16(12-15)22-18(25)13-23-8-10-24(11-9-23)19(26)14-27-17-4-6-21-7-5-17/h1-7,12H,8-11,13-14H2,(H,22,25)