1-(3,5-dimethylphenyl)-3-[(2,4-dimethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[(2,4-dimethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(2,4-dimethylanilino)-1-(3,5-dimethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(2,4-dimethylanilino)-1-(3,5-dimethylphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(2,4-dimethylanilino)-1-(3,5-dimethylphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(2,4-dimethylanilino)-1-(3,5-dimethylphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C26H24N2O2S MolecularWeight: 428.54596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=CC(=C3)C)C)SC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC(=CC(=C3)C)C)SC4=CC=CC=C4)C

InChI

InChI=1S/C26H24N2O2S/c1-16-10-11-22(19(4)13-16)27-23-24(31-21-8-6-5-7-9-21)26(30)28(25(23)29)20-14-17(2)12-18(3)15-20/h5-15,27H,1-4H3