2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanone

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanone Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanone CAS Name: 2-(1,3-benzothiazol-2-ylthio)-1-(2,4,6-trimethylphenyl)ethanone IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-1-(2,4,6-trimethylphenyl)ethanone Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-1-mesityl-ethanone Formula: C18H17NOS2 MolecularWeight: 327.46368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)CSC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)CSC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H17NOS2/c1-11-8-12(2)17(13(3)9-11)15(20)10-21-18-19-14-6-4-5-7-16(14)22-18/h4-9H,10H2,1-3H3