5-[6-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)methylsulfanyl]hexylsulfanylmethyl]-2-phenyl-4H-pyrazol-3-one

Systemtic Name: 5-[6-[(5-oxidanylidene-1-phenyl-4H-pyrazol-3-yl)methylsulfanyl]hexylsulfanylmethyl]-2-phenyl-4H-pyrazol-3-one Openeye Name: 5-[6-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)methylsulfanyl]hexylsulfanylmethyl]-2-phenyl-4H-pyrazol-3-one CAS Name: 5-[[6-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)methylthio]hexylthio]methyl]-2-phenyl-4H-pyrazol-3-one IUPAC Name: 5-[6-[(5-oxo-1-phenyl-4H-pyrazol-3-yl)methylsulfanyl]hexylsulfanylmethyl]-2-phenyl-4H-pyrazol-3-one Traditional Name: 5-[[6-[(5-keto-1-phenyl-2-pyrazolin-3-yl)methylthio]hexylthio]methyl]-2-phenyl-2-pyrazolin-3-one Formula: C26H30N4O2S2 MolecularWeight: 494.672

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1=O)C2=CC=CC=C2)CSCCCCCCSCC3=NN(C(=O)C3)C4=CC=CC=C4

Isomeric SMILES

C1C(=NN(C1=O)C2=CC=CC=C2)CSCCCCCCSCC3=NN(C(=O)C3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S2/c31-25-17-21(27-29(25)23-11-5-3-6-12-23)19-33-15-9-1-2-10-16-34-20-22-18-26(32)30(28-22)24-13-7-4-8-14-24/h3-8,11-14H,1-2,9-10,15-20H2