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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC

Isomeric SMILES

CCCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)C4CCOCC4)OC

InChI

InChI=1S/C22H25N3O3S/c1-3-4-16-13-15(7-10-23-16)21(26)25-22-24-19-18(27-2)6-5-17(20(19)29-22)14-8-11-28-12-9-14/h5-7,10,13-14H,3-4,8-9,11-12H2,1-2H3,(H,24,25,26)