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2-[3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione

2-[3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione

Systemtic Name:2-[3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione
Openeye Name:2-[3-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanylpropyl]isoindoline-1,3-dione
CAS Name:2-[3-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]propyl]isoindole-1,3-dione
IUPAC Name:2-[3-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanylpropyl]isoindole-1,3-dione
Traditional Name:2-[3-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]propyl]isoindoline-1,3-quinone
Formula: C20H25N3O2S
MolecularWeight: 371.4964
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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SCCCN2C(=O)C3=CC=CC=C3C2=O)C)C


Isomeric SMILES

CCCCN1C(=C(N=C1SCCCN2C(=O)C3=CC=CC=C3C2=O)C)C


InChI

InChI=1S/C20H25N3O2S/c1-4-5-11-22-15(3)14(2)21-20(22)26-13-8-12-23-18(24)16-9-6-7-10-17(16)19(23)25/h6-7,9-10H,4-5,8,11-13H2,1-3H3


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