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

Systemtic Name: 1-(4-chlorophenyl)-3-[(2-ethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 1-(4-chlorophenyl)-3-(2-ethylanilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(4-chlorophenyl)-3-(2-ethylanilino)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(4-chlorophenyl)-3-(2-ethylanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(4-chlorophenyl)-3-(2-ethylanilino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C25H21ClN2O2S MolecularWeight: 448.96444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21ClN2O2S/c1-3-17-6-4-5-7-21(17)27-22-23(31-20-14-8-16(2)9-15-20)25(30)28(24(22)29)19-12-10-18(26)11-13-19/h4-15,27H,3H2,1-2H3