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

Systemtic Name: 5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole Openeye Name: 5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole CAS Name: 5-[(2,4,6-trimethylphenyl)thio]-1H-pyrazole IUPAC Name: 5-(2,4,6-trimethylphenyl)sulfanyl-1H-pyrazole Traditional Name: 5-(mesitylthio)-1H-pyrazole Formula: C12H14N2S MolecularWeight: 218.31796

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N2S/c1-8-6-9(2)12(10(3)7-8)15-11-4-5-13-14-11/h4-7H,1-3H3,(H,13,14)