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

Systemtic Name: N-(1,3-benzothiazol-6-yl)-6-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-6-yl)-6-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxamide CAS Name: N-(1,3-benzothiazol-6-yl)-6-(2-phenyl-1-pyrrolidinyl)-3-pyridinecarboxamide IUPAC Name: N-(1,3-benzothiazol-6-yl)-6-(2-phenylpyrrolidin-1-yl)pyridine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-6-yl)-6-(2-phenylpyrrolidino)nicotinamide Formula: C23H20N4OS MolecularWeight: 400.4961

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H20N4OS/c28-23(26-18-9-10-19-21(13-18)29-15-25-19)17-8-11-22(24-14-17)27-12-4-7-20(27)16-5-2-1-3-6-16/h1-3,5-6,8-11,13-15,20H,4,7,12H2,(H,26,28)