5-[(1,3-benzothiazol-2-ylamino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Systemtic Name: 5-[(1,3-benzothiazol-2-ylamino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Openeye Name: 5-[(1,3-benzothiazol-2-ylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione CAS Name: 5-[(1,3-benzothiazol-2-ylamino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione IUPAC Name: 5-[(1,3-benzothiazol-2-ylamino)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione Traditional Name: 5-[(1,3-benzothiazol-2-ylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-quinone Formula: C14H12N2O4S MolecularWeight: 304.32108

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC(=O)C(=CNC2=NC3=CC=CC=C3S2)C(=O)O1)C

Isomeric SMILES

CC1(OC(=O)C(=CNC2=NC3=CC=CC=C3S2)C(=O)O1)C

InChI

InChI=1S/C14H12N2O4S/c1-14(2)19-11(17)8(12(18)20-14)7-15-13-16-9-5-3-4-6-10(9)21-13/h3-7H,1-2H3,(H,15,16)