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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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