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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-propan-2-ylphenyl)carbamothioyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[(2-isopropylphenyl)carbamothioyl]propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(2-propan-2-ylphenyl)carbamothioyl]propanamide Traditional Name: N-(o-cumenylthiocarbamoyl)-3-phthalimido-propionamide Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O3S/c1-13(2)14-7-5-6-10-17(14)22-21(28)23-18(25)11-12-24-19(26)15-8-3-4-9-16(15)20(24)27/h3-10,13H,11-12H2,1-2H3,(H2,22,23,25,28)