N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(4-ketocinnolin-1-yl)acetamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CN3C4=CC=CC=C4C(=O)C=N3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CN3C4=CC=CC=C4C(=O)C=N3

InChI

InChI=1S/C24H21N3O2S/c1-16-7-8-17(2)23(13-16)30-19-11-9-18(10-12-19)26-24(29)15-27-21-6-4-3-5-20(21)22(28)14-25-27/h3-14H,15H2,1-2H3,(H,26,29)