1-(9-fluoranyl-[1]benzothiolo[3,2-d]pyrimidin-4-yl)-N-phenethyl-piperidine-4-carboxamide

Systemtic Name: 1-(9-fluoranyl-[1]benzothiolo[3,2-d]pyrimidin-4-yl)-N-phenethyl-piperidine-4-carboxamide Openeye Name: 1-(9-fluorobenzothiopheno[3,2-d]pyrimidin-4-yl)-N-phenethyl-piperidine-4-carboxamide CAS Name: 1-(9-fluoro-[1]benzothiolo[3,2-d]pyrimidin-4-yl)-N-phenethyl-4-piperidinecarboxamide IUPAC Name: 1-(9-fluoro-[1]benzothiolo[3,2-d]pyrimidin-4-yl)-N-phenethylpiperidine-4-carboxamide Traditional Name: 1-(9-fluorobenzothiopheno[3,2-d]pyrimidin-4-yl)-N-phenethyl-isonipecotamide Formula: C24H23FN4OS MolecularWeight: 434.529023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NCCC2=CC=CC=C2)C3=NC=NC4=C3SC5=CC=CC(=C54)F

Isomeric SMILES

C1CN(CCC1C(=O)NCCC2=CC=CC=C2)C3=NC=NC4=C3SC5=CC=CC(=C54)F

InChI

InChI=1S/C24H23FN4OS/c25-18-7-4-8-19-20(18)21-22(31-19)23(28-15-27-21)29-13-10-17(11-14-29)24(30)26-12-9-16-5-2-1-3-6-16/h1-8,15,17H,9-14H2,(H,26,30)