4-chloranyl-5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole

Systemtic Name: 4-chloranyl-5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole Openeye Name: 4-chloro-5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole CAS Name: 4-chloro-5-[(2,4,6-trimethylphenyl)thio]-1H-pyrazole IUPAC Name: 4-chloro-5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole Traditional Name: 4-chloro-5-(mesitylthio)-1H-pyrazole Formula: C12H13ClN2S MolecularWeight: 252.76302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SC2=C(C=NN2)Cl)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SC2=C(C=NN2)Cl)C

InChI

InChI=1S/C12H13ClN2S/c1-7-4-8(2)11(9(3)5-7)16-12-10(13)6-14-15-12/h4-6H,1-3H3,(H,14,15)