3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-ethoxyphenyl)carbamothioyl]propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-ethoxyphenyl)carbamothioyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[(4-ethoxyphenyl)carbamothioyl]propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(4-ethoxyanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(4-ethoxyphenyl)carbamothioyl]propanamide Traditional Name: 3-phthalimido-N-(p-phenetylthiocarbamoyl)propionamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC1=CC=C(C=C1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H19N3O4S/c1-2-27-14-9-7-13(8-10-14)21-20(28)22-17(24)11-12-23-18(25)15-5-3-4-6-16(15)19(23)26/h3-10H,2,11-12H2,1H3,(H2,21,22,24,28)