2-[4-[methyl-[(4-methylsulfanylphenyl)methyl]amino]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[methyl-[(4-methylsulfanylphenyl)methyl]amino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[methyl-[(4-methylsulfanylphenyl)methyl]amino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[methyl-[[4-(methylthio)phenyl]methyl]amino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[methyl-[(4-methylsulfanylphenyl)methyl]amino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[methyl-[4-(methylthio)benzyl]amino]butyl]isoindoline-1,3-quinone Formula: C21H24N2O2S MolecularWeight: 368.49246

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCN1C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)SC

Isomeric SMILES

CN(CCCCN1C(=O)C2=CC=CC=C2C1=O)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C21H24N2O2S/c1-22(15-16-9-11-17(26-2)12-10-16)13-5-6-14-23-20(24)18-7-3-4-8-19(18)21(23)25/h3-4,7-12H,5-6,13-15H2,1-2H3