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

Systemtic Name: 3-[(4-ethoxyphenyl)amino]-4-(4-methylphenyl)sulfanyl-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4-ethoxyanilino)-1-phenethyl-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-(4-ethoxyanilino)-4-[(4-methylphenyl)thio]-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4-ethoxyanilino)-4-(4-methylphenyl)sulfanyl-1-phenethylpyrrole-2,5-dione Traditional Name: 1-phenethyl-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:

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)C

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)C

InChI

InChI=1S/C27H26N2O3S/c1-3-32-22-13-11-21(12-14-22)28-24-25(33-23-15-9-19(2)10-16-23)27(31)29(26(24)30)18-17-20-7-5-4-6-8-20/h4-16,28H,3,17-18H2,1-2H3