3-[(3,4-dimethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-phenoxyphenyl)pyrrole-2,5-dione

Systemtic Name: 3-[(3,4-dimethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-(4-phenoxyphenyl)pyrrole-2,5-dione Openeye Name: 3-(3,4-dimethylanilino)-1-(4-phenoxyphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(3,4-dimethylanilino)-4-[(4-methylphenyl)thio]-1-(4-phenoxyphenyl)pyrrole-2,5-dione IUPAC Name: 3-(3,4-dimethylanilino)-4-(4-methylphenyl)sulfanyl-1-(4-phenoxyphenyl)pyrrole-2,5-dione Traditional Name: 3-(3,4-dimethylanilino)-1-(4-phenoxyphenyl)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C31H26N2O3S MolecularWeight: 506.61474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)NC5=CC(=C(C=C5)C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)NC5=CC(=C(C=C5)C)C

InChI

InChI=1S/C31H26N2O3S/c1-20-9-17-27(18-10-20)37-29-28(32-23-12-11-21(2)22(3)19-23)30(34)33(31(29)35)24-13-15-26(16-14-24)36-25-7-5-4-6-8-25/h4-19,32H,1-3H3