2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethylhexylcarbamothioyl)ethanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-ethylhexylcarbamothioyl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(2-ethylhexylcarbamothioyl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[(2-ethylhexylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(2-ethylhexylcarbamothioyl)acetamide Traditional Name: N-(2-ethylhexylthiocarbamoyl)-2-phthalimido-acetamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)NC(=O)CN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCC(CC)CNC(=S)NC(=O)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C19H25N3O3S/c1-3-5-8-13(4-2)11-20-19(26)21-16(23)12-22-17(24)14-9-6-7-10-15(14)18(22)25/h6-7,9-10,13H,3-5,8,11-12H2,1-2H3,(H2,20,21,23,26)