2-[(benzo[g][1,3]benzothiazol-2-ylamino)methylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(benzo[g][1,3]benzothiazol-2-ylamino)methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(benzo[g][1,3]benzothiazol-2-ylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(2-benzo[g][1,3]benzothiazolylamino)methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(benzo[g][1,3]benzothiazol-2-ylamino)methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(benzo[g][1,3]benzothiazol-2-ylamino)methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C20H18N2O2S MolecularWeight: 350.43412

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(=CNC2=NC3=C(S2)C4=CC=CC=C4C=C3)C(=O)C1)C

Isomeric SMILES

CC1(CC(=O)C(=CNC2=NC3=C(S2)C4=CC=CC=C4C=C3)C(=O)C1)C

InChI

InChI=1S/C20H18N2O2S/c1-20(2)9-16(23)14(17(24)10-20)11-21-19-22-15-8-7-12-5-3-4-6-13(12)18(15)25-19/h3-8,11H,9-10H2,1-2H3,(H,21,22)