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

Systemtic Name: 1-(2,4-dimethylphenyl)-3-[(3,4-dimethylphenyl)amino]-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(3,4-dimethylanilino)-1-(2,4-dimethylphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(3,4-dimethylanilino)-1-(2,4-dimethylphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(3,4-dimethylanilino)-1-(2,4-dimethylphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(3,4-dimethylanilino)-1-(2,4-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)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=CC=C3)NC4=CC(=C(C=C4)C)C)C

InChI

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