2-(furan-2-ylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 2-(2-furylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone CAS Name: 2-(2-furanylmethylthio)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-(furan-2-ylmethylsulfanyl)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-(2-furfurylthio)-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N=C1C2=CC=CC=C2)C(=O)CSCC3=CC=CO3

Isomeric SMILES

C1CN(N=C1C2=CC=CC=C2)C(=O)CSCC3=CC=CO3

InChI

InChI=1S/C16H16N2O2S/c19-16(12-21-11-14-7-4-10-20-14)18-9-8-15(17-18)13-5-2-1-3-6-13/h1-7,10H,8-9,11-12H2