2-[2-(4-butan-2-ylsulfanylphenyl)sulfanylethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-(4-butan-2-ylsulfanylphenyl)sulfanylethyl]isoindole-1,3-dione Openeye Name: 2-[2-(4-sec-butylsulfanylphenyl)sulfanylethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[4-(butan-2-ylthio)phenyl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-(4-butan-2-ylsulfanylphenyl)sulfanylethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[4-(sec-butylthio)phenyl]thio]ethyl]isoindoline-1,3-quinone Formula: C20H21NO2S2 MolecularWeight: 371.51624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(C)SC1=CC=C(C=C1)SCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C20H21NO2S2/c1-3-14(2)25-16-10-8-15(9-11-16)24-13-12-21-19(22)17-6-4-5-7-18(17)20(21)23/h4-11,14H,3,12-13H2,1-2H3