2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole

Systemtic Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Openeye Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole CAS Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)-3-pyrazolyl]-1,3-benzothiazole IUPAC Name: 2-[2-(4-methylsulfonylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Traditional Name: 2-[2-(4-mesylphenyl)-5-(trifluoromethyl)pyrazol-3-yl]-1,3-benzothiazole Formula: C18H12F3N3O2S2 MolecularWeight: 423.43199

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C(F)(F)F)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H12F3N3O2S2/c1-28(25,26)12-8-6-11(7-9-12)24-14(10-16(23-24)18(19,20)21)17-22-13-4-2-3-5-15(13)27-17/h2-10H,1H3