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

Systemtic Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(phenethylamino)pyridine-4-carboxamide Openeye Name: N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-2-(phenethylamino)pyridine-4-carboxamide CAS Name: N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-2-(phenethylamino)-4-pyridinecarboxamide IUPAC Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(phenethylamino)pyridine-4-carboxamide Traditional Name: N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-2-(phenethylamino)isonicotinamide Formula: C26H27N5O3S MolecularWeight: 489.58928

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)N3CCOCC3)SC(=N2)NC(=O)C4=CC(=NC=C4)NCCC5=CC=CC=C5

Isomeric SMILES

COC1=C2C(=C(C=C1)N3CCOCC3)SC(=N2)NC(=O)C4=CC(=NC=C4)NCCC5=CC=CC=C5

InChI

InChI=1S/C26H27N5O3S/c1-33-21-8-7-20(31-13-15-34-16-14-31)24-23(21)29-26(35-24)30-25(32)19-10-12-28-22(17-19)27-11-9-18-5-3-2-4-6-18/h2-8,10,12,17H,9,11,13-16H2,1H3,(H,27,28)(H,29,30,32)