[1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-[(4-cyanophenyl)methylsulfanyl]benzoate

Systemtic Name: [1,3-bis(oxidanylidene)isoindol-2-yl]methyl 2-[(4-cyanophenyl)methylsulfanyl]benzoate Openeye Name: (1,3-dioxoisoindolin-2-yl)methyl 2-[(4-cyanophenyl)methylsulfanyl]benzoate CAS Name: 2-[(4-cyanophenyl)methylthio]benzoic acid (1,3-dioxo-2-isoindolyl)methyl ester IUPAC Name: (1,3-dioxoisoindol-2-yl)methyl 2-[(4-cyanophenyl)methylsulfanyl]benzoate Traditional Name: 2-[(4-cyanobenzyl)thio]benzoic acid phthalimidomethyl ester Formula: C24H16N2O4S MolecularWeight: 428.45984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)COC(=O)C3=CC=CC=C3SCC4=CC=C(C=C4)C#N

InChI

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