1-(1,3-benzothiazol-2-yl)pentane-1,3-dione

Systemtic Name: 1-(1,3-benzothiazol-2-yl)pentane-1,3-dione Openeye Name: 1-(1,3-benzothiazol-2-yl)pentane-1,3-dione CAS Name: 1-(1,3-benzothiazol-2-yl)pentane-1,3-dione IUPAC Name: 1-(1,3-benzothiazol-2-yl)pentane-1,3-dione Traditional Name: 1-(1,3-benzothiazol-2-yl)pentane-1,3-dione Formula: C12H11NO2S MolecularWeight: 233.28624

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC(=O)C1=NC2=CC=CC=C2S1

Isomeric SMILES

CCC(=O)CC(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C12H11NO2S/c1-2-8(14)7-10(15)12-13-9-5-3-4-6-11(9)16-12/h3-6H,2,7H2,1H3