N-(4-fluorophenyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide

Systemtic Name: N-(4-fluorophenyl)-1-quinolin-8-ylsulfonyl-piperidine-3-carboxamide Openeye Name: N-(4-fluorophenyl)-1-(8-quinolylsulfonyl)piperidine-3-carboxamide CAS Name: N-(4-fluorophenyl)-1-(8-quinolinylsulfonyl)-3-piperidinecarboxamide IUPAC Name: N-(4-fluorophenyl)-1-quinolin-8-ylsulfonylpiperidine-3-carboxamide Traditional Name: N-(4-fluorophenyl)-1-(8-quinolylsulfonyl)nipecotamide Formula: C21H20FN3O3S MolecularWeight: 413.465203

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)C2=CC=CC3=C2N=CC=C3)C(=O)NC4=CC=C(C=C4)F

InChI

InChI=1S/C21H20FN3O3S/c22-17-8-10-18(11-9-17)24-21(26)16-6-3-13-25(14-16)29(27,28)19-7-1-4-15-5-2-12-23-20(15)19/h1-2,4-5,7-12,16H,3,6,13-14H2,(H,24,26)