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

Systemtic Name: 3-[(4-ethoxyphenyl)amino]-1-(4-ethylphenyl)-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 3-(4-ethoxyanilino)-1-(4-ethylphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(4-ethoxyanilino)-1-(4-ethylphenyl)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 3-(4-ethoxyanilino)-1-(4-ethylphenyl)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(4-ethylphenyl)-3-(p-phenetidino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C27H26N2O3S MolecularWeight: 458.57194

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NC4=CC=C(C=C4)OCC

Isomeric SMILES

CCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NC4=CC=C(C=C4)OCC

InChI

InChI=1S/C27H26N2O3S/c1-4-19-8-12-21(13-9-19)29-26(30)24(28-20-10-14-22(15-11-20)32-5-2)25(27(29)31)33-23-16-6-18(3)7-17-23/h6-17,28H,4-5H2,1-3H3