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

Systemtic Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(4-methyl-3-oxidanylidene-piperazin-1-yl)pyridine-4-carboxamide Openeye Name: N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)-2-(4-methyl-3-oxo-piperazin-1-yl)pyridine-4-carboxamide CAS Name: N-[4-methoxy-7-(4-morpholinyl)-1,3-benzothiazol-2-yl]-2-(4-methyl-3-oxo-1-piperazinyl)-4-pyridinecarboxamide IUPAC Name: N-(4-methoxy-7-morpholin-4-yl-1,3-benzothiazol-2-yl)-2-(4-methyl-3-oxopiperazin-1-yl)pyridine-4-carboxamide Traditional Name: 2-(3-keto-4-methyl-piperazino)-N-(4-methoxy-7-morpholino-1,3-benzothiazol-2-yl)isonicotinamide Formula: C23H26N6O4S MolecularWeight: 482.55534

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1=O)C2=NC=CC(=C2)C(=O)NC3=NC4=C(C=CC(=C4S3)N5CCOCC5)OC

Isomeric SMILES

CN1CCN(CC1=O)C2=NC=CC(=C2)C(=O)NC3=NC4=C(C=CC(=C4S3)N5CCOCC5)OC

InChI

InChI=1S/C23H26N6O4S/c1-27-7-8-29(14-19(27)30)18-13-15(5-6-24-18)22(31)26-23-25-20-17(32-2)4-3-16(21(20)34-23)28-9-11-33-12-10-28/h3-6,13H,7-12,14H2,1-2H3,(H,25,26,31)