N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(methylaminomethyl)pyridine-4-carboxamide

Systemtic Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(methylaminomethyl)pyridine-4-carboxamide Openeye Name: N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-2-(methylaminomethyl)pyridine-4-carboxamide CAS Name: N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-2-(methylaminomethyl)-4-pyridinecarboxamide IUPAC Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(methylaminomethyl)pyridine-4-carboxamide Traditional Name: N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-2-(methylaminomethyl)isonicotinamide Formula: C20H23N5O3S MolecularWeight: 413.49332

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

Isomeric SMILES

CNCC1=NC=CC(=C1)C(=O)NC2=NC3=C(C=CC(=C3S2)N4CCOCC4)OC

InChI

InChI=1S/C20H23N5O3S/c1-21-12-14-11-13(5-6-22-14)19(26)24-20-23-17-16(27-2)4-3-15(18(17)29-20)25-7-9-28-10-8-25/h3-6,11,21H,7-10,12H2,1-2H3,(H,23,24,26)