2-(1,3-benzothiazol-6-yl)-4,4-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-(1,3-benzothiazol-6-yl)-4,4-dimethyl-cyclohex-2-en-1-one Openeye Name: 2-(1,3-benzothiazol-6-yl)-4,4-dimethyl-cyclohex-2-en-1-one CAS Name: 2-(1,3-benzothiazol-6-yl)-4,4-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-(1,3-benzothiazol-6-yl)-4,4-dimethylcyclohex-2-en-1-one Traditional Name: 2-(1,3-benzothiazol-6-yl)-4,4-dimethyl-cyclohex-2-en-1-one Formula: C15H15NOS MolecularWeight: 257.3507

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=O)C(=C1)C2=CC3=C(C=C2)N=CS3)C

Isomeric SMILES

CC1(CCC(=O)C(=C1)C2=CC3=C(C=C2)N=CS3)C

InChI

InChI=1S/C15H15NOS/c1-15(2)6-5-13(17)11(8-15)10-3-4-12-14(7-10)18-9-16-12/h3-4,7-9H,5-6H2,1-2H3