1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(3-ethanoylphenoxy)ethanone

Systemtic Name: 1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)-2-(3-ethanoylphenoxy)ethanone Openeye Name: 2-(3-acetylphenoxy)-1-[3,5-bis(2-thienyl)-3,4-dihydropyrazol-2-yl]ethanone CAS Name: 2-(3-acetylphenoxy)-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone IUPAC Name: 2-(3-acetylphenoxy)-1-(3,5-dithiophen-2-yl-3,4-dihydropyrazol-2-yl)ethanone Traditional Name: 2-(3-acetylphenoxy)-1-[3,5-bis(2-thienyl)-2-pyrazolin-1-yl]ethanone Formula: C21H18N2O3S2 MolecularWeight: 410.50922

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)OCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)OCC(=O)N2C(CC(=N2)C3=CC=CS3)C4=CC=CS4

InChI

InChI=1S/C21H18N2O3S2/c1-14(24)15-5-2-6-16(11-15)26-13-21(25)23-18(20-8-4-10-28-20)12-17(22-23)19-7-3-9-27-19/h2-11,18H,12-13H2,1H3