2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylidene]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[[(6-methoxy-1,3-benzothiazol-2-yl)amino]methylene]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O3S/c1-17(2)7-13(20)11(14(21)8-17)9-18-16-19-12-5-4-10(22-3)6-15(12)23-16/h4-6,9H,7-8H2,1-3H3,(H,18,19)