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

Systemtic Name: 3-[(2-ethylphenyl)amino]-1-(4-phenoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(2-ethylanilino)-1-(4-phenoxyphenyl)-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(2-ethylanilino)-1-(4-phenoxyphenyl)-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(2-ethylanilino)-1-(4-phenoxyphenyl)-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(2-ethylanilino)-1-(4-phenoxyphenyl)-4-(phenylthio)-3-pyrroline-2,5-quinone Formula: C30H24N2O3S MolecularWeight: 492.58816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)SC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OC4=CC=CC=C4)SC5=CC=CC=C5

InChI

InChI=1S/C30H24N2O3S/c1-2-21-11-9-10-16-26(21)31-27-28(36-25-14-7-4-8-15-25)30(34)32(29(27)33)22-17-19-24(20-18-22)35-23-12-5-3-6-13-23/h3-20,31H,2H2,1H3