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

Systemtic Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-[(2-hydroxyphenyl)amino]pyrrole-2,5-dione Openeye Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(2-hydroxyanilino)pyrrole-2,5-dione CAS Name: 1-(4-butylphenyl)-3-[(4-chlorophenyl)thio]-4-(2-hydroxyanilino)pyrrole-2,5-dione IUPAC Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(2-hydroxyanilino)pyrrole-2,5-dione Traditional Name: 1-(4-butylphenyl)-3-[(4-chlorophenyl)thio]-4-(2-hydroxyanilino)-3-pyrroline-2,5-quinone Formula: C26H23ClN2O3S MolecularWeight: 478.99042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)NC4=CC=CC=C4O

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)NC4=CC=CC=C4O

InChI

InChI=1S/C26H23ClN2O3S/c1-2-3-6-17-9-13-19(14-10-17)29-25(31)23(28-21-7-4-5-8-22(21)30)24(26(29)32)33-20-15-11-18(27)12-16-20/h4-5,7-16,28,30H,2-3,6H2,1H3