N-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-2-propan-2-yl-pyridine-4-carboxamide

Systemtic Name: N-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-2-propan-2-yl-pyridine-4-carboxamide Openeye Name: 2-isopropyl-N-(4-methoxy-7-tetrahydropyran-4-yl-1,3-benzothiazol-2-yl)pyridine-4-carboxamide CAS Name: N-[4-methoxy-7-(4-oxanyl)-1,3-benzothiazol-2-yl]-2-propan-2-yl-4-pyridinecarboxamide IUPAC Name: N-[4-methoxy-7-(oxan-4-yl)-1,3-benzothiazol-2-yl]-2-propan-2-ylpyridine-4-carboxamide Traditional Name: 2-isopropyl-N-(4-methoxy-7-tetrahydropyran-4-yl-1,3-benzothiazol-2-yl)isonicotinamide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC

Isomeric SMILES

CC(C)C1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC

InChI

InChI=1S/C22H25N3O3S/c1-13(2)17-12-15(6-9-23-17)21(26)25-22-24-19-18(27-3)5-4-16(20(19)29-22)14-7-10-28-11-8-14/h4-6,9,12-14H,7-8,10-11H2,1-3H3,(H,24,25,26)