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

Systemtic Name: 1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-phenylazanyl-pyrrole-2,5-dione Openeye Name: 3-anilino-1-(4-butylphenyl)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 3-anilino-1-(4-butylphenyl)-4-[(4-methylphenyl)thio]pyrrole-2,5-dione IUPAC Name: 3-anilino-1-(4-butylphenyl)-4-(4-methylphenyl)sulfanylpyrrole-2,5-dione Traditional Name: 3-anilino-1-(4-butylphenyl)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C27H26N2O2S MolecularWeight: 442.57254

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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)NC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C27H26N2O2S/c1-3-4-8-20-13-15-22(16-14-20)29-26(30)24(28-21-9-6-5-7-10-21)25(27(29)31)32-23-17-11-19(2)12-18-23/h5-7,9-18,28H,3-4,8H2,1-2H3