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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-1-(4-ethoxyphenyl)-4-[(4-ethylphenyl)amino]pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-1-(4-ethoxyphenyl)-4-(4-ethylanilino)pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-1-(4-ethoxyphenyl)-4-(4-ethylanilino)pyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-1-(4-ethoxyphenyl)-4-(4-ethylanilino)pyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(4-ethylanilino)-1-p-phenetyl-3-pyrroline-2,5-quinone Formula: C26H23ClN2O3S MolecularWeight: 478.99042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OCC)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)C3=CC=C(C=C3)OCC)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H23ClN2O3S/c1-3-17-5-9-19(10-6-17)28-23-24(33-22-15-7-18(27)8-16-22)26(31)29(25(23)30)20-11-13-21(14-12-20)32-4-2/h5-16,28H,3-4H2,1-2H3