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

Systemtic Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(5-cyano-2-pyridyl)piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(5-cyano-2-pyridinyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(5-cyanopyridin-2-yl)piperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-ylmethyl)phenyl]-1-(5-cyano-2-pyridyl)isonipecotamide Formula: C26H23N5OS MolecularWeight: 453.55872

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C5=NC=C(C=C5)C#N

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC=C(C=C2)CC3=NC4=CC=CC=C4S3)C5=NC=C(C=C5)C#N

InChI

InChI=1S/C26H23N5OS/c27-16-19-7-10-24(28-17-19)31-13-11-20(12-14-31)26(32)29-21-8-5-18(6-9-21)15-25-30-22-3-1-2-4-23(22)33-25/h1-10,17,20H,11-15H2,(H,29,32)