3-[[4-(3,5-dimethylpyrazol-1-yl)-5-phenyl-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol

Systemtic Name: 3-[[4-(3,5-dimethylpyrazol-1-yl)-5-phenyl-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol Openeye Name: 3-[[4-(3,5-dimethylpyrazol-1-yl)-5-phenyl-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol CAS Name: 3-[[4-(3,5-dimethyl-1-pyrazolyl)-5-phenyl-1H-pyrazol-3-yl]thio]-1-propanethiol IUPAC Name: 3-[[4-(3,5-dimethylpyrazol-1-yl)-5-phenyl-1H-pyrazol-3-yl]sulfanyl]propane-1-thiol Traditional Name: 3-[[4-(3,5-dimethylpyrazol-1-yl)-5-phenyl-1H-pyrazol-3-yl]thio]propane-1-thiol Formula: C17H20N4S2 MolecularWeight: 344.4975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=C(NN=C2SCCCS)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=NN1C2=C(NN=C2SCCCS)C3=CC=CC=C3)C

InChI

InChI=1S/C17H20N4S2/c1-12-11-13(2)21(20-12)16-15(14-7-4-3-5-8-14)18-19-17(16)23-10-6-9-22/h3-5,7-8,11,22H,6,9-10H2,1-2H3,(H,18,19)