N-(1,3-benzothiazol-6-yl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-6-yl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-6-yl)-2-[2-(2-pyridyl)pyrrolidin-1-yl]pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-6-yl)-2-[2-(2-pyridinyl)-1-pyrrolidinyl]-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-2-(2-pyridin-2-ylpyrrolidin-1-yl)pyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-6-yl)-2-[2-(2-pyridyl)pyrrolidino]nicotinamide Formula: C22H19N5OS MolecularWeight: 401.48416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=C(C=CC=N2)C(=O)NC3=CC4=C(C=C3)N=CS4)C5=CC=CC=N5

Isomeric SMILES

C1CC(N(C1)C2=C(C=CC=N2)C(=O)NC3=CC4=C(C=C3)N=CS4)C5=CC=CC=N5

InChI

InChI=1S/C22H19N5OS/c28-22(26-15-8-9-18-20(13-15)29-14-25-18)16-5-3-11-24-21(16)27-12-4-7-19(27)17-6-1-2-10-23-17/h1-3,5-6,8-11,13-14,19H,4,7,12H2,(H,26,28)