2-(3,5-dimethylphenyl)-5-(phenylcarbonyl)-1,2-thiazol-3-one

Systemtic Name: 2-(3,5-dimethylphenyl)-5-(phenylcarbonyl)-1,2-thiazol-3-one Openeye Name: 5-benzoyl-2-(3,5-dimethylphenyl)isothiazol-3-one CAS Name: 5-benzoyl-2-(3,5-dimethylphenyl)-3-isothiazolone IUPAC Name: 5-benzoyl-2-(3,5-dimethylphenyl)-1,2-thiazol-3-one Traditional Name: 5-benzoyl-2-(3,5-dimethylphenyl)-4-isothiazolin-3-one Formula: C18H15NO2S MolecularWeight: 309.3822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=O)C=C(S2)C(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=O)C=C(S2)C(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H15NO2S/c1-12-8-13(2)10-15(9-12)19-17(20)11-16(22-19)18(21)14-6-4-3-5-7-14/h3-11H,1-2H3