1-[3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-methylsulfanyl-pyrazol-1-yl]ethanone

Systemtic Name: 1-[3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-methylsulfanyl-pyrazol-1-yl]ethanone Openeye Name: 1-[3-[(E)-2-(4-methoxyphenyl)vinyl]-5-methylsulfanyl-pyrazol-1-yl]ethanone CAS Name: 1-[3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-(methylthio)-1-pyrazolyl]ethanone IUPAC Name: 1-[3-[(E)-2-(4-methoxyphenyl)ethenyl]-5-methylsulfanylpyrazol-1-yl]ethanone Traditional Name: 1-[3-[(E)-2-(4-methoxyphenyl)vinyl]-5-(methylthio)pyrazol-1-yl]ethanone Formula: C15H16N2O2S MolecularWeight: 288.36474

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=CC(=N1)C=CC2=CC=C(C=C2)OC)SC

Isomeric SMILES

CC(=O)N1C(=CC(=N1)/C=C/C2=CC=C(C=C2)OC)SC

InChI

InChI=1S/C15H16N2O2S/c1-11(18)17-15(20-3)10-13(16-17)7-4-12-5-8-14(19-2)9-6-12/h4-10H,1-3H3/b7-4+