2-butan-2-ylsulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-butan-2-ylsulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-sec-butylsulfanyl-ethanone CAS Name: 2-(butan-2-ylthio)-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-butan-2-ylsulfanyl-1-(5-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-2-(sec-butylthio)ethanone Formula: C15H20N2OS MolecularWeight: 276.3971

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SCC(=O)N1CCC(=N1)C2=CC=CC=C2

Isomeric SMILES

CCC(C)SCC(=O)N1CCC(=N1)C2=CC=CC=C2

InChI

InChI=1S/C15H20N2OS/c1-3-12(2)19-11-15(18)17-10-9-14(16-17)13-7-5-4-6-8-13/h4-8,12H,3,9-11H2,1-2H3