N-[3-[[4-(2-fluorophenyl)piperazin-1-yl]-pyridin-3-yl-methyl]-4,5-dimethyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-yl]-pyridin-3-yl-methyl]-4,5-dimethyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-yl]-(3-pyridyl)methyl]-4,5-dimethyl-2-thienyl]furan-2-carboxamide CAS Name: N-[3-[[4-(2-fluorophenyl)-1-piperazinyl]-(3-pyridinyl)methyl]-4,5-dimethyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[3-[[4-(2-fluorophenyl)piperazin-1-yl]-pyridin-3-ylmethyl]-4,5-dimethylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[3-[[4-(2-fluorophenyl)piperazino]-(3-pyridyl)methyl]-4,5-dimethyl-2-thienyl]-2-furamide Formula: C27H27FN4O2S MolecularWeight: 490.592283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4F)NC(=O)C5=CC=CO5)C

Isomeric SMILES

CC1=C(SC(=C1C(C2=CN=CC=C2)N3CCN(CC3)C4=CC=CC=C4F)NC(=O)C5=CC=CO5)C

InChI

InChI=1S/C27H27FN4O2S/c1-18-19(2)35-27(30-26(33)23-10-6-16-34-23)24(18)25(20-7-5-11-29-17-20)32-14-12-31(13-15-32)22-9-4-3-8-21(22)28/h3-11,16-17,25H,12-15H2,1-2H3,(H,30,33)