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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(phenylmethyl)carbamothioyl]propanamide Openeye Name: N-(benzylcarbamothioyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[[(phenylmethyl)amino]-sulfanylidenemethyl]propanamide IUPAC Name: N-(benzylcarbamothioyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(benzylthiocarbamoyl)-3-phthalimido-propionamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)CNC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17N3O3S/c23-16(21-19(26)20-12-13-6-2-1-3-7-13)10-11-22-17(24)14-8-4-5-9-15(14)18(22)25/h1-9H,10-12H2,(H2,20,21,23,26)