[6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-naphthalen-2-yl-5-oxidanylidene-1,4-thiazepan-4-yl] ethanoate

Systemtic Name: [6-[1,3-bis(oxidanylidene)isoindol-2-yl]-2-naphthalen-2-yl-5-oxidanylidene-1,4-thiazepan-4-yl] ethanoate Openeye Name: [6-(1,3-dioxoisoindolin-2-yl)-2-(2-naphthyl)-5-oxo-1,4-thiazepan-4-yl] acetate CAS Name: acetic acid [6-(1,3-dioxo-2-isoindolyl)-2-(2-naphthalenyl)-5-oxo-1,4-thiazepan-4-yl] ester IUPAC Name: [6-(1,3-dioxoisoindol-2-yl)-2-naphthalen-2-yl-5-oxo-1,4-thiazepan-4-yl] acetate Traditional Name: acetic acid [5-keto-2-(2-naphthyl)-6-phthalimido-1,4-thiazepan-4-yl] ester Formula: C25H20N2O5S MolecularWeight: 460.5017

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON1CC(SCC(C1=O)N2C(=O)C3=CC=CC=C3C2=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC(=O)ON1CC(SCC(C1=O)N2C(=O)C3=CC=CC=C3C2=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H20N2O5S/c1-15(28)32-26-13-22(18-11-10-16-6-2-3-7-17(16)12-18)33-14-21(25(26)31)27-23(29)19-8-4-5-9-20(19)24(27)30/h2-12,21-22H,13-14H2,1H3