3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(diethylcarbamothioyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(diethylcarbamothioyl)propanamide Openeye Name: N-(diethylcarbamothioyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[diethylamino(sulfanylidene)methyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(diethylcarbamothioyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(diethylthiocarbamoyl)-3-phthalimido-propionamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)NC(=O)CCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCN(CC)C(=S)NC(=O)CCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C16H19N3O3S/c1-3-18(4-2)16(23)17-13(20)9-10-19-14(21)11-7-5-6-8-12(11)15(19)22/h5-8H,3-4,9-10H2,1-2H3,(H,17,20,23)