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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=C(C=C2)F)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

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