1-[3-(furan-2-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-methylsulfanyl-ethanone

Systemtic Name: 1-[3-(furan-2-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-methylsulfanyl-ethanone Openeye Name: 1-[3-(2-furyl)-5-(p-tolyl)-3,4-dihydropyrazol-2-yl]-2-methylsulfanyl-ethanone CAS Name: 1-[3-(2-furanyl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-(methylthio)ethanone IUPAC Name: 1-[3-(furan-2-yl)-5-(4-methylphenyl)-3,4-dihydropyrazol-2-yl]-2-methylsulfanylethanone Traditional Name: 1-[5-(2-furyl)-3-(p-tolyl)-2-pyrazolin-1-yl]-2-(methylthio)ethanone Formula: C17H18N2O2S MolecularWeight: 314.40202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=O)CSC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(C2)C3=CC=CO3)C(=O)CSC

InChI

InChI=1S/C17H18N2O2S/c1-12-5-7-13(8-6-12)14-10-15(16-4-3-9-21-16)19(18-14)17(20)11-22-2/h3-9,15H,10-11H2,1-2H3