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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(oxolan-2-ylmethylcarbamothioyl)propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-(tetrahydrofuran-2-ylmethylcarbamothioyl)propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(2-oxolanylmethylamino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-(oxolan-2-ylmethylcarbamothioyl)propanamide Traditional Name: 3-phthalimido-N-(tetrahydrofurfurylthiocarbamoyl)propionamide Formula: C17H19N3O4S MolecularWeight: 361.41546

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1CC(OC1)CNC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H19N3O4S/c21-14(19-17(25)18-10-11-4-3-9-24-11)7-8-20-15(22)12-5-1-2-6-13(12)16(20)23/h1-2,5-6,11H,3-4,7-10H2,(H2,18,19,21,25)