2-(4-methylphenyl)sulfanyl-1-(3-phenyl-3,4-dihydropyrazol-2-yl)ethanone

Systemtic Name: 2-(4-methylphenyl)sulfanyl-1-(3-phenyl-3,4-dihydropyrazol-2-yl)ethanone Openeye Name: 1-(3-phenyl-3,4-dihydropyrazol-2-yl)-2-(p-tolylsulfanyl)ethanone CAS Name: 2-[(4-methylphenyl)thio]-1-(3-phenyl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-(4-methylphenyl)sulfanyl-1-(3-phenyl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 1-(5-phenyl-2-pyrazolin-1-yl)-2-(p-tolylthio)ethanone Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)N2C(CC=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)N2C(CC=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2OS/c1-14-7-9-16(10-8-14)22-13-18(21)20-17(11-12-19-20)15-5-3-2-4-6-15/h2-10,12,17H,11,13H2,1H3