3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)propanamide

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)propanamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-3-(1,3-dioxoisoindolin-2-yl)propanamide CAS Name: N-[(2,3-dihydro-1,4-benzodioxin-6-ylamino)-sulfanylidenemethyl]-3-(1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylcarbamothioyl)-3-(1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylthiocarbamoyl)-3-phthalimido-propionamide Formula: C20H17N3O5S MolecularWeight: 411.43108

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)NC(=S)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)NC(=S)NC(=O)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N3O5S/c24-17(7-8-23-18(25)13-3-1-2-4-14(13)19(23)26)22-20(29)21-12-5-6-15-16(11-12)28-10-9-27-15/h1-6,11H,7-10H2,(H2,21,22,24,29)