N-benzo[e][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-1-(4-fluorobenzoyl)isonipecotamide Formula: C24H20FN3O2S MolecularWeight: 433.497903

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=NC3=C(S2)C=CC4=CC=CC=C43)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C24H20FN3O2S/c25-18-8-5-17(6-9-18)23(30)28-13-11-16(12-14-28)22(29)27-24-26-21-19-4-2-1-3-15(19)7-10-20(21)31-24/h1-10,16H,11-14H2,(H,26,27,29)