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

Systemtic Name: 1-(4-chloranyl-2-methyl-phenyl)-3-[(2-ethylphenyl)amino]-4-(4-methylphenyl)sulfanyl-pyrrole-2,5-dione Openeye Name: 1-(4-chloro-2-methyl-phenyl)-3-(2-ethylanilino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(4-chloro-2-methylphenyl)-3-(2-ethylanilino)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 1-(4-chloro-2-methylphenyl)-3-(2-ethylanilino)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 1-(4-chloro-2-methyl-phenyl)-3-(2-ethylanilino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C26H23ClN2O2S MolecularWeight: 462.99102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23ClN2O2S/c1-4-18-7-5-6-8-21(18)28-23-24(32-20-12-9-16(2)10-13-20)26(31)29(25(23)30)22-14-11-19(27)15-17(22)3/h5-15,28H,4H2,1-3H3