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

Systemtic Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-(3-oxidanylazetidin-1-yl)pyridine-4-carboxamide Openeye Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-(3-hydroxyazetidin-1-yl)pyridine-4-carboxamide CAS Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-(3-hydroxy-1-azetidinyl)-4-pyridinecarboxamide IUPAC Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-(3-hydroxyazetidin-1-yl)pyridine-4-carboxamide Traditional Name: N-[7-(1,4-dioxan-2-yl)-4-methoxy-1,3-benzothiazol-2-yl]-2-(3-hydroxyazetidin-1-yl)isonicotinamide Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)C3COCCO3)SC(=N2)NC(=O)C4=CC(=NC=C4)N5CC(C5)O

Isomeric SMILES

COC1=C2C(=C(C=C1)C3COCCO3)SC(=N2)NC(=O)C4=CC(=NC=C4)N5CC(C5)O

InChI

InChI=1S/C21H22N4O5S/c1-28-15-3-2-14(16-11-29-6-7-30-16)19-18(15)23-21(31-19)24-20(27)12-4-5-22-17(8-12)25-9-13(26)10-25/h2-5,8,13,16,26H,6-7,9-11H2,1H3,(H,23,24,27)