2-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylpyrazol-1-yl)ethanone

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylpyrazol-1-yl)ethanone Openeye Name: 2-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylpyrazol-1-yl)ethanone CAS Name: 2-[(4-chlorophenyl)thio]-1-(3,5-dimethyl-1-pyrazolyl)ethanone IUPAC Name: 2-(4-chlorophenyl)sulfanyl-1-(3,5-dimethylpyrazol-1-yl)ethanone Traditional Name: 2-[(4-chlorophenyl)thio]-1-(3,5-dimethylpyrazol-1-yl)ethanone Formula: C13H13ClN2OS MolecularWeight: 280.77312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(=O)CSC2=CC=C(C=C2)Cl)C

Isomeric SMILES

CC1=CC(=NN1C(=O)CSC2=CC=C(C=C2)Cl)C

InChI

InChI=1S/C13H13ClN2OS/c1-9-7-10(2)16(15-9)13(17)8-18-12-5-3-11(14)4-6-12/h3-7H,8H2,1-2H3