3,5-dimethyl-1-[(1S)-1-phenylsulfanylethyl]pyrazole

Systemtic Name: 3,5-dimethyl-1-[(1S)-1-phenylsulfanylethyl]pyrazole Openeye Name: 3,5-dimethyl-1-[(1S)-1-phenylsulfanylethyl]pyrazole CAS Name: 3,5-dimethyl-1-[(1S)-1-(phenylthio)ethyl]pyrazole IUPAC Name: 3,5-dimethyl-1-[(1S)-1-phenylsulfanylethyl]pyrazole Traditional Name: 3,5-dimethyl-1-[(1S)-1-(phenylthio)ethyl]pyrazole Formula: C13H16N2S MolecularWeight: 232.34454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C(C)SC2=CC=CC=C2)C

Isomeric SMILES

CC1=CC(=NN1[C@H](C)SC2=CC=CC=C2)C

InChI

InChI=1S/C13H16N2S/c1-10-9-11(2)15(14-10)12(3)16-13-7-5-4-6-8-13/h4-9,12H,1-3H3/t12-/m0/s1