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

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-4-[(4-ethylphenyl)amino]-1-phenethyl-pyrrole-2,5-dione Openeye Name: 3-(4-chlorophenyl)sulfanyl-4-(4-ethylanilino)-1-phenethyl-pyrrole-2,5-dione CAS Name: 3-[(4-chlorophenyl)thio]-4-(4-ethylanilino)-1-phenethylpyrrole-2,5-dione IUPAC Name: 3-(4-chlorophenyl)sulfanyl-4-(4-ethylanilino)-1-phenethylpyrrole-2,5-dione Traditional Name: 3-[(4-chlorophenyl)thio]-4-(4-ethylanilino)-1-phenethyl-3-pyrroline-2,5-quinone Formula: C26H23ClN2O2S MolecularWeight: 462.99102

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC=C(C=C1)NC2=C(C(=O)N(C2=O)CCC3=CC=CC=C3)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H23ClN2O2S/c1-2-18-8-12-21(13-9-18)28-23-24(32-22-14-10-20(27)11-15-22)26(31)29(25(23)30)17-16-19-6-4-3-5-7-19/h3-15,28H,2,16-17H2,1H3