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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=CS4)C5=CN=CC=C5

Isomeric SMILES

C1CC(N(C1)C2=NC=C(C=C2)C(=O)NC3=CC4=C(C=C3)N=CS4)C5=CN=CC=C5

InChI

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