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

Systemtic Name: 3-[ethyl(phenyl)amino]-1-phenethyl-4-phenylsulfanyl-pyrrole-2,5-dione Openeye Name: 3-(N-ethylanilino)-1-phenethyl-4-phenylsulfanyl-pyrrole-2,5-dione CAS Name: 3-(N-ethylanilino)-1-phenethyl-4-(phenylthio)pyrrole-2,5-dione IUPAC Name: 3-(N-ethylanilino)-1-phenethyl-4-phenylsulfanylpyrrole-2,5-dione Traditional Name: 3-(N-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:

CCN(C1=CC=CC=C1)C2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=CC=C4

Isomeric SMILES

CCN(C1=CC=CC=C1)C2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=CC=C4

InChI

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