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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(2-methylphenyl)carbamothioyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-(o-tolylcarbamothioyl)propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(2-methylanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(2-methylphenyl)carbamothioyl]propanamide Traditional Name: N-(o-tolylthiocarbamoyl)-3-phthalimido-propionamide Formula: C19H17N3O3S MolecularWeight: 367.42158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C19H17N3O3S/c1-12-6-2-5-9-15(12)20-19(26)21-16(23)10-11-22-17(24)13-7-3-4-8-14(13)18(22)25/h2-9H,10-11H2,1H3,(H2,20,21,23,26)