2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]isoindole-1,3-dione

Systemtic Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Openeye Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]isoindoline-1,3-dione CAS Name: 2-[[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]methyl]isoindole-1,3-dione IUPAC Name: 2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylmethyl]isoindole-1,3-dione Traditional Name: 2-[[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]methyl]isoindoline-1,3-quinone Formula: C20H17N3O2S MolecularWeight: 363.43288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=CN=C2SCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=CN=C2SCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C20H17N3O2S/c1-13-7-8-14(2)17(11-13)22-10-9-21-20(22)26-12-23-18(24)15-5-3-4-6-16(15)19(23)25/h3-11H,12H2,1-2H3