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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-butoxyphenyl)carbamothioyl]ethanamide Openeye Name: N-[(2-butoxyphenyl)carbamothioyl]-2-(1,3-dioxoisoindolin-2-yl)acetamide CAS Name: N-[(2-butoxyanilino)-sulfanylidenemethyl]-2-(1,3-dioxo-2-isoindolyl)acetamide IUPAC Name: N-[(2-butoxyphenyl)carbamothioyl]-2-(1,3-dioxoisoindol-2-yl)acetamide Traditional Name: N-[(2-butoxyphenyl)thiocarbamoyl]-2-phthalimido-acetamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1NC(=S)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCOC1=CC=CC=C1NC(=S)NC(=O)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O4S/c1-2-3-12-28-17-11-7-6-10-16(17)22-21(29)23-18(25)13-24-19(26)14-8-4-5-9-15(14)20(24)27/h4-11H,2-3,12-13H2,1H3,(H2,22,23,25,29)