3,4-bis(3-methyl-4-methylsulfanyl-phenoxy)-1-phenyl-pyrrole-2,5-dione

Systemtic Name: 3,4-bis(3-methyl-4-methylsulfanyl-phenoxy)-1-phenyl-pyrrole-2,5-dione Openeye Name: 3,4-bis(3-methyl-4-methylsulfanyl-phenoxy)-1-phenyl-pyrrole-2,5-dione CAS Name: 3,4-bis[3-methyl-4-(methylthio)phenoxy]-1-phenylpyrrole-2,5-dione IUPAC Name: 3,4-bis(3-methyl-4-methylsulfanylphenoxy)-1-phenylpyrrole-2,5-dione Traditional Name: 3,4-bis[3-methyl-4-(methylthio)phenoxy]-1-phenyl-3-pyrroline-2,5-quinone Formula: C26H23NO4S2 MolecularWeight: 477.59512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=C(C(=O)N(C2=O)C3=CC=CC=C3)OC4=CC(=C(C=C4)SC)C)SC

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=C(C(=O)N(C2=O)C3=CC=CC=C3)OC4=CC(=C(C=C4)SC)C)SC

InChI

InChI=1S/C26H23NO4S2/c1-16-14-19(10-12-21(16)32-3)30-23-24(31-20-11-13-22(33-4)17(2)15-20)26(29)27(25(23)28)18-8-6-5-7-9-18/h5-15H,1-4H3