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

Systemtic Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-[(4-methoxyphenyl)amino]pyrrole-2,5-dione Openeye Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-methoxyanilino)pyrrole-2,5-dione CAS Name: 1-(4-butylphenyl)-3-[(4-chlorophenyl)thio]-4-(4-methoxyanilino)pyrrole-2,5-dione IUPAC Name: 1-(4-butylphenyl)-3-(4-chlorophenyl)sulfanyl-4-(4-methoxyanilino)pyrrole-2,5-dione Traditional Name: 1-(4-butylphenyl)-3-[(4-chlorophenyl)thio]-4-(p-anisidino)-3-pyrroline-2,5-quinone Formula: C27H25ClN2O3S MolecularWeight: 493.017

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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=C(C=C4)OC

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)Cl)NC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H25ClN2O3S/c1-3-4-5-18-6-12-21(13-7-18)30-26(31)24(29-20-10-14-22(33-2)15-11-20)25(27(30)32)34-23-16-8-19(28)9-17-23/h6-17,29H,3-5H2,1-2H3