4-[bis(ethylsulfanyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: 4-[bis(ethylsulfanyl)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: 4-[bis(ethylsulfanyl)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: 4-[bis(ethylthio)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: 4-[bis(ethylsulfanyl)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: 4-[bis(ethylthio)methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C15H18N2OS2 MolecularWeight: 306.44622

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)SCC

Isomeric SMILES

CCSC(=C1C(=NN(C1=O)C2=CC=CC=C2)C)SCC

InChI

InChI=1S/C15H18N2OS2/c1-4-19-15(20-5-2)13-11(3)16-17(14(13)18)12-9-7-6-8-10-12/h6-10H,4-5H2,1-3H3