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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O2S/c1-2-20-13-9-10-16-22(20)27-23-24(31-21-14-7-4-8-15-21)26(30)28(25(23)29)18-17-19-11-5-3-6-12-19/h3-16,27H,2,17-18H2,1H3