1-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)-2-phenoxy-ethanone

Systemtic Name: 1-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)-2-phenoxy-ethanone Openeye Name: 1-(3,5-dimethyl-4-phenylsulfanyl-pyrazol-1-yl)-2-phenoxy-ethanone CAS Name: 1-[3,5-dimethyl-4-(phenylthio)-1-pyrazolyl]-2-phenoxyethanone IUPAC Name: 1-(3,5-dimethyl-4-phenylsulfanylpyrazol-1-yl)-2-phenoxyethanone Traditional Name: 1-[3,5-dimethyl-4-(phenylthio)pyrazol-1-yl]-2-phenoxy-ethanone Formula: C19H18N2O2S MolecularWeight: 338.42342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C(=O)COC2=CC=CC=C2)C)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C(=O)COC2=CC=CC=C2)C)SC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O2S/c1-14-19(24-17-11-7-4-8-12-17)15(2)21(20-14)18(22)13-23-16-9-5-3-6-10-16/h3-12H,13H2,1-2H3