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

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(pentylcarbamothioyl)ethanamide Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)-N-(pentylcarbamothioyl)acetamide CAS Name: 2-(1,3-dioxo-2-isoindolyl)-N-[(pentylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)-N-(pentylcarbamothioyl)acetamide Traditional Name: N-(amylthiocarbamoyl)-2-phthalimido-acetamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=S)NC(=O)CN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCCNC(=S)NC(=O)CN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C16H19N3O3S/c1-2-3-6-9-17-16(23)18-13(20)10-19-14(21)11-7-4-5-8-12(11)15(19)22/h4-5,7-8H,2-3,6,9-10H2,1H3,(H2,17,18,20,23)