(E)-1-(1,3-benzothiazol-2-yl)-4-methyl-pent-2-en-1-one

Systemtic Name: (E)-1-(1,3-benzothiazol-2-yl)-4-methyl-pent-2-en-1-one Openeye Name: (E)-1-(1,3-benzothiazol-2-yl)-4-methyl-pent-2-en-1-one CAS Name: (E)-1-(1,3-benzothiazol-2-yl)-4-methyl-2-penten-1-one IUPAC Name: (E)-1-(1,3-benzothiazol-2-yl)-4-methylpent-2-en-1-one Traditional Name: (E)-1-(1,3-benzothiazol-2-yl)-4-methyl-pent-2-en-1-one Formula: C13H13NOS MolecularWeight: 231.31342

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)/C=C/C(=O)C1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H13NOS/c1-9(2)7-8-11(15)13-14-10-5-3-4-6-12(10)16-13/h3-9H,1-2H3/b8-7+