1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-pyrrolidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-pyrrolidin-1-yl-pyrrole-2,5-dione Openeye Name: 1-(4-butylphenyl)-3-(p-tolylsulfanyl)-4-pyrrolidin-1-yl-pyrrole-2,5-dione CAS Name: 1-(4-butylphenyl)-3-[(4-methylphenyl)thio]-4-(1-pyrrolidinyl)pyrrole-2,5-dione IUPAC Name: 1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-pyrrolidin-1-ylpyrrole-2,5-dione Traditional Name: 1-(4-butylphenyl)-3-(p-tolylthio)-4-pyrrolidino-3-pyrroline-2,5-quinone Formula: C25H28N2O2S MolecularWeight: 420.56702

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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)C)N4CCCC4

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)N4CCCC4

InChI

InChI=1S/C25H28N2O2S/c1-3-4-7-19-10-12-20(13-11-19)27-24(28)22(26-16-5-6-17-26)23(25(27)29)30-21-14-8-18(2)9-15-21/h8-15H,3-7,16-17H2,1-2H3