2-[(5-ethyl-2-ethylsulfanyl-thiophen-3-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(5-ethyl-2-ethylsulfanyl-thiophen-3-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(5-ethyl-2-ethylsulfanyl-3-thienyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[5-ethyl-2-(ethylthio)-3-thiophenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(5-ethyl-2-ethylsulfanylthiophen-3-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[[5-ethyl-2-(ethylthio)-3-thienyl]methyl]isoindoline-1,3-quinone Formula: C17H17NO2S2 MolecularWeight: 331.45238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)SCC)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC1=CC(=C(S1)SCC)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C17H17NO2S2/c1-3-12-9-11(17(22-12)21-4-2)10-18-15(19)13-7-5-6-8-14(13)16(18)20/h5-9H,3-4,10H2,1-2H3