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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1COCCN1C2=NC3=C(S2)C=C(C=C3)NC(=O)CCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H20N4O4S/c27-19(7-8-26-20(28)15-3-1-2-4-16(15)21(26)29)23-14-5-6-17-18(13-14)31-22(24-17)25-9-11-30-12-10-25/h1-6,13H,7-12H2,(H,23,27)