N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide

Systemtic Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[3-(1,3-benzothiazol-2-yl)phenyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C25H21N5OS MolecularWeight: 439.53214

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C5=NC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4S3)C5=NC=C(C=C5)C#N

InChI

InChI=1S/C25H21N5OS/c26-15-17-8-9-23(27-16-17)30-12-10-18(11-13-30)24(31)28-20-5-3-4-19(14-20)25-29-21-6-1-2-7-22(21)32-25/h1-9,14,16,18H,10-13H2,(H,28,31)