2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2,6-diethylphenyl)carbamothioyl]ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2,6-diethylphenyl)carbamothioyl]ethanamide Openeye Name: N-[(2,6-diethylphenyl)carbamothioyl]-2-(1,3-dioxoisoindolin-2-yl)acetamide CAS Name: N-[(2,6-diethylanilino)-sulfanylidenemethyl]-2-(1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[(2,6-diethylphenyl)carbamothioyl]-2-(1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[(2,6-diethylphenyl)thiocarbamoyl]-2-phthalimido-acetamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O3S/c1-3-13-8-7-9-14(4-2)18(13)23-21(28)22-17(25)12-24-19(26)15-10-5-6-11-16(15)20(24)27/h5-11H,3-4,12H2,1-2H3,(H2,22,23,25,28)