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

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-(4-fluorophenyl)carbonyl-piperidine-4-carboxamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-(4-fluorobenzoyl)piperidine-4-carboxamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-1-(4-fluorobenzoyl)isonipecotamide Formula: C26H22FN3O2S MolecularWeight: 459.535183

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC=C2C3=NC4=CC=CC=C4S3)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FN3O2S/c27-19-11-9-18(10-12-19)26(32)30-15-13-17(14-16-30)24(31)28-21-6-2-1-5-20(21)25-29-22-7-3-4-8-23(22)33-25/h1-12,17H,13-16H2,(H,28,31)