O-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl] N-(4-propan-2-ylphenyl)carbamothioate

Systemtic Name: O-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl] N-(4-propan-2-ylphenyl)carbamothioate Openeye Name: O-[2-(1,3-dioxoisoindolin-2-yl)ethyl] N-(4-isopropylphenyl)carbamothioate CAS Name: N-(4-propan-2-ylphenyl)carbamothioic acid O-[2-(1,3-dioxo-2-isoindolyl)ethyl] ester IUPAC Name: O-[2-(1,3-dioxoisoindol-2-yl)ethyl] N-(4-propan-2-ylphenyl)carbamothioate Traditional Name: N-p-cumenylthiocarbamic acid O-(2-phthalimidoethyl) ester Formula: C20H20N2O3S MolecularWeight: 368.4494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=S)OCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=S)OCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H20N2O3S/c1-13(2)14-7-9-15(10-8-14)21-20(26)25-12-11-22-18(23)16-5-3-4-6-17(16)19(22)24/h3-10,13H,11-12H2,1-2H3,(H,21,26)