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

Systemtic Name: 1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-(naphthalen-1-ylamino)pyrrole-2,5-dione Openeye Name: 1-(4-butylphenyl)-3-(1-naphthylamino)-4-(p-tolylsulfanyl)pyrrole-2,5-dione CAS Name: 1-(4-butylphenyl)-3-[(4-methylphenyl)thio]-4-(1-naphthalenylamino)pyrrole-2,5-dione IUPAC Name: 1-(4-butylphenyl)-3-(4-methylphenyl)sulfanyl-4-(naphthalen-1-ylamino)pyrrole-2,5-dione Traditional Name: 1-(4-butylphenyl)-3-(1-naphthylamino)-4-(p-tolylthio)-3-pyrroline-2,5-quinone Formula: C31H28N2O2S MolecularWeight: 492.63122

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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=CC5=CC=CC=C54

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=C(C2=O)SC3=CC=C(C=C3)C)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C31H28N2O2S/c1-3-4-8-22-15-17-24(18-16-22)33-30(34)28(29(31(33)35)36-25-19-13-21(2)14-20-25)32-27-12-7-10-23-9-5-6-11-26(23)27/h5-7,9-20,32H,3-4,8H2,1-2H3