1-(2,6-dimethylphenyl)-3-[4-[(3-oxidanylidene-1H-2-benzofuran-1-yl)amino]phenyl]sulfanyl-pyrrolidine-2,5-dione

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[4-[(3-oxidanylidene-1H-2-benzofuran-1-yl)amino]phenyl]sulfanyl-pyrrolidine-2,5-dione Openeye Name: 1-(2,6-dimethylphenyl)-3-[4-[(3-oxo-1H-isobenzofuran-1-yl)amino]phenyl]sulfanyl-pyrrolidine-2,5-dione CAS Name: 1-(2,6-dimethylphenyl)-3-[[4-[(3-oxo-1H-isobenzofuran-1-yl)amino]phenyl]thio]pyrrolidine-2,5-dione IUPAC Name: 1-(2,6-dimethylphenyl)-3-[4-[(3-oxo-1H-2-benzofuran-1-yl)amino]phenyl]sulfanylpyrrolidine-2,5-dione Traditional Name: 1-(2,6-dimethylphenyl)-3-[[4-(phthalidylamino)phenyl]thio]pyrrolidine-2,5-quinone Formula: C26H22N2O4S MolecularWeight: 458.52888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)NC4C5=CC=CC=C5C(=O)O4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=O)CC(C2=O)SC3=CC=C(C=C3)NC4C5=CC=CC=C5C(=O)O4

InChI

InChI=1S/C26H22N2O4S/c1-15-6-5-7-16(2)23(15)28-22(29)14-21(25(28)30)33-18-12-10-17(11-13-18)27-24-19-8-3-4-9-20(19)26(31)32-24/h3-13,21,24,27H,14H2,1-2H3