2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(2-morpholino-1,3-benzothiazol-6-yl)propanamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[2-(4-morpholinyl)-1,3-benzothiazol-6-yl]propanamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-morpholin-4-yl-1,3-benzothiazol-6-yl)propanamide Traditional Name: N-(2-morpholino-1,3-benzothiazol-6-yl)-2-phthalimido-propionamide Formula: C22H20N4O4S MolecularWeight: 436.4836

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

CC(C(=O)NC1=CC2=C(C=C1)N=C(S2)N3CCOCC3)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H20N4O4S/c1-13(26-20(28)15-4-2-3-5-16(15)21(26)29)19(27)23-14-6-7-17-18(12-14)31-22(24-17)25-8-10-30-11-9-25/h2-7,12-13H,8-11H2,1H3,(H,23,27)