2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-morpholin-4-ylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-morpholin-4-ylphenyl)carbamothioyl]ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-[(4-morpholinophenyl)carbamothioyl]acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[[4-(4-morpholinyl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-[(4-morpholin-4-ylphenyl)carbamothioyl]acetamide Traditional Name: N-[(4-morpholinophenyl)thiocarbamoyl]-2-phthalimido-acetamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=S)NC(=O)CN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H20N4O4S/c26-18(13-25-19(27)16-3-1-2-4-17(16)20(25)28)23-21(30)22-14-5-7-15(8-6-14)24-9-11-29-12-10-24/h1-8H,9-13H2,(H2,22,23,26,30)