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

Systemtic Name: 3-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-[(4-propan-2-yloxyphenyl)carbamothioyl]propanamide Openeye Name: 3-(1,3-dioxoisoindolin-2-yl)-N-[(4-isopropoxyphenyl)carbamothioyl]propanamide CAS Name: 3-(1,3-dioxo-2-isoindolyl)-N-[(4-propan-2-yloxyanilino)-sulfanylidenemethyl]propanamide IUPAC Name: 3-(1,3-dioxoisoindol-2-yl)-N-[(4-propan-2-yloxyphenyl)carbamothioyl]propanamide Traditional Name: N-[(4-isopropoxyphenyl)thiocarbamoyl]-3-phthalimido-propionamide Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=S)NC(=O)CCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O4S/c1-13(2)28-15-9-7-14(8-10-15)22-21(29)23-18(25)11-12-24-19(26)16-5-3-4-6-17(16)20(24)27/h3-10,13H,11-12H2,1-2H3,(H2,22,23,25,29)