3-methylsulfanyl-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole

Systemtic Name: 3-methylsulfanyl-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole Openeye Name: 3-methylsulfanyl-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole CAS Name: 3-(methylthio)-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole IUPAC Name: 3-methylsulfanyl-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole Traditional Name: 3-(methylthio)-5-[(1E,3E,5E)-6-phenylhexa-1,3,5-trienyl]-1H-pyrazole Formula: C16H16N2S MolecularWeight: 268.37664

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NNC(=C1)C=CC=CC=CC2=CC=CC=C2

Isomeric SMILES

CSC1=NNC(=C1)/C=C/C=C/C=C/C2=CC=CC=C2

InChI

InChI=1S/C16H16N2S/c1-19-16-13-15(17-18-16)12-8-3-2-5-9-14-10-6-4-7-11-14/h2-13H,1H3,(H,17,18)/b3-2+,9-5+,12-8+