1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(2,4,6-trimethylphenyl)sulfanyl-ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[(2,4,6-trimethylphenyl)thio]ethanone IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-(2,4,6-trimethylphenyl)sulfanylethanone Traditional Name: 2-(mesitylthio)-1-(3-phenyl-2-pyrazolin-1-yl)ethanone Formula: C20H22N2OS MolecularWeight: 338.46648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)SCC(=O)N2CCC(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)SCC(=O)N2CCC(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C20H22N2OS/c1-14-11-15(2)20(16(3)12-14)24-13-19(23)22-10-9-18(21-22)17-7-5-4-6-8-17/h4-8,11-12H,9-10,13H2,1-3H3