2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(2-cyanophenyl)sulfanylbenzoate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 2-(2-cyanophenyl)sulfanylbenzoate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 2-(2-cyanophenyl)sulfanylbenzoate CAS Name: 2-[(2-cyanophenyl)thio]benzoic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 2-(2-cyanophenyl)sulfanylbenzoate Traditional Name: 2-[(2-cyanophenyl)thio]benzoic acid 2-phthalimidoethyl ester Formula: C24H16N2O4S MolecularWeight: 428.45984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C(=C1)C#N)SC2=CC=CC=C2C(=O)OCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C24H16N2O4S/c25-15-16-7-1-5-11-20(16)31-21-12-6-4-10-19(21)24(29)30-14-13-26-22(27)17-8-2-3-9-18(17)23(26)28/h1-12H,13-14H2